CID
int64 1
171M
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| IUPACName
stringlengths 3
2.71k
⌀ | InChI
stringlengths 10
3.8k
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stringlengths 1
1.71k
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101 | 3-Hydroxybenzaldehyde | C7H6O2 | 3-hydroxybenzaldehyde | InChI=1S/C7H6O2/c8-5-6-2-1-3-7(9)4-6/h1-5,9H | C1=CC(=CC(=C1)O)C=O | ['3-hydroxybenzaldehyde', 'm-Hydroxybenzaldehyde', 'Benzaldehyde, 3-hydroxy-', 'm-Formylphenol', '3-Formylphenol', 'meta-Hydroxybenzaldehyde', 'Benzaldehyde, m-hydroxy-', '3-HYDROXY-BENZALDEHYDE', '3-Hydroxybenzaldehyd', '3-oxidanylbenzaldehyde', 'm-hydroxy benzaldehyde', '3-hydroxy benzaldehyde', 'mFormylphenol', '3Formylphenol', 'mHydroxybenzaldehyde', '3-hydroxylbenzaldehyde', 'metaHydroxybenzaldehyde', 'Benzaldehyde, mhydroxy', 'Benzaldehyde, 3hydroxy', '3-hydroxy benzoaldehyde', 'Hydroxybenzaldehyde, 3-', '(3-hydroxyphenyl)methanone', '(3-hydroxyphenyl) formaldehyde', 'HYDROXYBENZALDEHYDE. 3-'] |
102 | 3-Hydroxybenzyl alcohol | C7H8O2 | 3-(hydroxymethyl)phenol | InChI=1S/C7H8O2/c8-5-6-2-1-3-7(9)4-6/h1-4,8-9H,5H2 | C1=CC(=CC(=C1)O)CO | ['3-hydroxybenzyl alcohol', '3-(Hydroxymethyl)phenol', 'Benzenemethanol, 3-hydroxy-', '3-Hydroxybenzenemethanol', 'm-Hydroxybenzyl alcohol', 'Benzyl alcohol, m-hydroxy-', '3-Hydroxybenzylalcohol', '3-Hydroxymethyl-phenol', '3-(hydroxymethyl)-phenol', '3-hydroxymethylphenol', '3-hydroxymethyl phenol', '3-(Hydroxymethy)phenol', '3-hydroxy benzyl alcohol', '3-hydroxy-phenyl-methanol', 'phenol, 3-hydroxymethyl-', '3-(hydroxy)benzyl alcohol', '3-(Hydroxymethyl)phenol #', '3-[(Hydroxy)methyl]phenol', 'HYDROXYBENZYL ALCOHOL, M-', 'InChI=1/C7H8O2/c8-5-6-2-1-3-7(9)4-6/h1-4,8-9H,5H', '3HY'] |
103 | 3-oxo-cholyl-CoA; (Acyl-CoA); [M+H]+ | C45H72N7O20P3S | S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 4-(7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pentanethioate | InChI=1S/C45H72N7O20P3S/c1-23(26-7-8-27-34-28(18-31(55)45(26,27)5)44(4)12-10-25(53)16-24(44)17-29(34)54)6-9-33(57)76-15-14-47-32(56)11-13-48-41(60)38(59)43(2,3)20-69-75(66,67)72-74(64,65)68-19-30-37(71-73(61,62)63)36(58)42(70-30)52-22-51-35-39(46)49-21-50-40(35)52/h21-24,26-31,34,36-38,42,54-55,58-59H,6-20H2,1-5H3,(H,47,56)(H,48,60)(H,64,65)(H,66,67)(H2,46,49,50)(H2,61,62,63) | CC(CCC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O)C4CCC5C4(C(CC6C5C(CC7C6(CCC(=O)C7)C)O)O)C | ['3-oxo-cholyl-CoA; (Acyl-CoA); [M+H]+;'] |
104 | 5-Oxo-4,5-dihydro-2-furylacetic acid | C6H6O4 | 2-(2-oxo-3H-furan-5-yl)acetic acid | InChI=1S/C6H6O4/c7-5(8)3-4-1-2-6(9)10-4/h1H,2-3H2,(H,7,8) | C1C=C(OC1=O)CC(=O)O | ['5-oxo-4,5-dihydro-2-furylacetic acid', '3-Oxoadipate enol-lactone', '2-(2-oxo-3H-furan-5-yl)acetic acid', '(5-oxo-4,5-dihydrofuran-2-yl)acetic acid', '2-oxo-2,3-dihydrofuran-5-acetate', '4,5-dihydro-5-oxofuran-2-acetate', '5-oxo-4,5-dihydrofuran-2-acetate', '4-carboxymethylbut-3-en-4-olide'] |
105 | Phosphohydroxypyruvic acid | C3H5O7P | 2-oxo-3-phosphonooxypropanoic acid | InChI=1S/C3H5O7P/c4-2(3(5)6)1-10-11(7,8)9/h1H2,(H,5,6)(H2,7,8,9) | C(C(=O)C(=O)O)OP(=O)(O)O | ['Phosphohydroxypyruvic acid', '2-oxo-3-(phosphonooxy)propanoic acid', '3-Phosphonooxypyruvic acid', '3-phosphonooxypyruvate', '2-oxo-3-phosphonooxypropanoic acid', 'Propanoic acid, 2-oxo-3-(phosphonooxy)-', '3-Phosphohydroxypyruvic acid', 'Hydroxypyruvic acid phosphate', '3-phosphohydroxypyruvate', 'Hydroxypyruvic Acid Phosphate Barium Salt', '3-Phosphonatooxypyruvate', '2-oxo-3-(phosphonooxy)-Propanoate', '2-oxo-3-(phosphonooxy)propanoicacid', '2-oxo-3-(phosphonooxy)-Propanoic acid', 'PYRUVIC ACID, HYDROXY-, PHOSPHATE', '2-OXIDANYLIDENE-3-PHOSPHONOOXY-PROPANOIC ACID', '3-Hydroxy-2,2-dimethoxy-propanoic acid-3-phosphatetri(cyclohexylammonium)salt'] |
106 | O-Phospho-DL-serine | C3H8NO6P | 2-amino-3-phosphonooxypropanoic acid | InChI=1S/C3H8NO6P/c4-2(3(5)6)1-10-11(7,8)9/h2H,1,4H2,(H,5,6)(H2,7,8,9) | C(C(C(=O)O)N)OP(=O)(O)O | ['dl-O-Phosphoserine', 'O-Phospho-DL-serine', 'DL-Serine dihydrogen phosphate', 'Serophen', 'serine phosphate', 'Energoserina', 'o-Phosphonoserine', 'phosphorylserine', 'serine, O-phosphono-', 'DL-O-Phosphorylserine', 'DL-Serine monophosphoric acid', 'P-serine', 'DL-Phosphoserine', '2-amino-3-phosphonooxypropanoic acid', '3-phospho-1-serine', 'DL-O-Serine phosphate', '2-amino-3-(phosphonooxy)propanoic acid', 'DL-Serine, dihydrogen phosphate (ester)', '3-phospho-serine', 'serine-3-phosphate', 'H-D-Ser(POH)-OH', 'DL-Serine monophosphorate', 'DL-2-Amino-3-hydroxypropanoic acid 3-phosphate', 'PHOSPHOSERINE, DL-', 'H-DL-Ser(H2PO3)-OH', 'SERINE PHOSPHATE [WHO-DD]', 'H-Ser(POH)-OH', '(RS)-2-AMINO-3-PHOSPHONOOXY PROPANOIC ACID', 'SERINE, DIHYDROGEN PHOSPHATE (ESTER), DL-', 'seryl phosphate', 'L-Serine, dihydrogen phosphate (ester)', 'DL-SOP', 'o-phosphoserin', 'P-ser', 'serine-3-p', '3-P-serine', '2-amino-3-(oxyphosphinyloxyphosphinyl)propanoic acid', '2-Amino-3-(phosphonooxy)propanoate', 'DL-Serine dihydrogen phosphoric acid', '(R)-2-amino-3-(phosphonooxy)propanoicacid', 'Serine, dihydrogen phosphate (ester) (9CI)', 'DL-Serine, dihydrogen phosphoric acid (ester)', 'Serine, dihydrogen phosphate (ester), DL- (8CI)'] |
107 | 3-Phenylpropionic acid | C9H10O2 | 3-phenylpropanoic acid | InChI=1S/C9H10O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11) | C1=CC=C(C=C1)CCC(=O)O | ['hydrocinnamic acid', '3-phenylpropionic acid', '3-Phenylpropanoic acid', 'Benzenepropanoic acid', 'Benzylacetic acid', 'Dihydrocinnamic acid', 'Benzenepropionic acid', '3-Phenyl propionic acid', 'Phenylpropanoic acid', '3-Phenyl-propionic acid', 'Phenylpropanoate', 'BETA-PHENYLPROPIONIC ACID', 'Phenylpropionic acid', 'PHENYL PROPIONIC ACID', 'hydrocinnamate', '.beta.-Phenylpropanoic acid', '.beta.-Phenylpropionic acid', 'HYDROCINNAMIC-D5 ACID', '3PP', 'Hydrocinnamic Acid (3-Phenylpropanoic Acid)', '3-PHENYLPROPIONIC ACID3-Phenyl-propionic acid', 'HCI', '3-Phenylpropionic acid;3-Phenylpropanoic acid;3-Phenyl-n-propionic acid', 'beta-phenylpropionate', 'Hydrozimtsaeure', 'Dihydrocinnamate', 'hydrocinnamicacid', 'Benzenepropionate', 'Hyrocinnamic acid', 'b-Phenylpropionate', 'w-Phenylpropanoate', '1ahx', '1tog', '1toi', '1toj', '3-Phenylpropionsaeure', 'omega-Phenylpropanoate', '3-phenylproionic acid', 'b-Phenylpropionic acid', 'w-Phenylpropanoic acid', '3-Phenyl-n-propionate', 'beta-Phenylpropioic acid', '3-phenyl-propanoic acid', '3-Phenyl propanoic acid', 'omega-Phenylpropanoic acid', '3-Phenyl-n-propionic acid', '3-phenylpropionic acid D5', 'I(2)-phenylpropionic acid', 'propanoic acid, 3-phenyl-', 'Hydrocinnamic acid (Standard)', 'HYDROCINNAMIC ACID [MI]', '3PP; 3-PHENYLPROPIONIC ACID', '3-PHENYLPROPIONIC ACID [FHFI]', 'Hydrocinnamic acid, analytical standard', 'Hydrocinnamic acid; 3-Phenylpropanoic acid; beta-Phenylpropionic acid'] |
108 | 3-Pyridineacetic acid | C7H7NO2 | 2-pyridin-3-ylacetic acid | InChI=1S/C7H7NO2/c9-7(10)4-6-2-1-3-8-5-6/h1-3,5H,4H2,(H,9,10) | C1=CC(=CN=C1)CC(=O)O | ['3-pyridineacetic acid', '3-pyridylacetic acid', '2-(pyridin-3-yl)acetic acid', 'lioxone', 'minedil', 'piridil', 'Piristerol', 'lessterol', 'toneon', '2-(3-pyridyl)acetic acid', 'coletin', '2-pyridin-3-ylacetic acid', 'homonicotinic acid', 'pyridine-3-acetic acid', 'pyridin-3-ylacetic acid', '(pyridin-3-yl)acetic acid', '3-pyridyl acetic acid', '3-Pyridinylacetic acid', '3-pyridylacetate', '3-pyridine-acetic acid', '3-Pyridilacetic Acid', '3-pyridyl-acetic acid', '3-Carboxymethylpyridine', 'a-(3-Pyridyl)acetate', '3-Pyridine acetic acid', '2-(3-Pyridyl)acetate', '3PAA', '(3-pyridyl)ethanoic acid', 'pyridin-3-yl-acetic acid', '3-Pyridinylacetic acid #', 'alpha-(3-Pyridyl)acetate', '2-(Pyridin-3-yl)acetate', 'a-(3-Pyridyl)acetic acid', 'alpha-(3-Pyridyl)acetic acid', '3-PYRIDINEACETIC ACID [MI]', '.ALPHA.-(3-PYRIDYL)ACETIC ACID', '3-Pyridineacetic acid,sodium salt(1:1)', 'RISEDRONATE SODIUM 2.5-HYDRATE IMPURITY D [EP IMPURITY]', 'RISEDRONATE SODIUM IMPURITY, 3-PYRIDYL ACETIC ACID-[USP IMPURITY]'] |
109 | 3-Sulfinoalanine | C3H7NO4S | 2-amino-3-sulfinopropanoic acid | InChI=1S/C3H7NO4S/c4-2(3(5)6)1-9(7)8/h2H,1,4H2,(H,5,6)(H,7,8) | C(C(C(=O)O)N)S(=O)O | ['Cysteine sulfinic acid', '3-sulfinoalanine', '2-amino-3-sulfinopropanoic acid', 'Alanine, 3-sulfino-', 'UZY4HYK4ZX', 'Sulfino-DL-alanine', 'L-Cysteine sulfinic acid', 'Cysteinesulfinic acid', 'ALANINESULFINIC ACID', 'CYSTEINESULFINATE, DL-', 'CYSTEINESULFINIC ACID, (DL)-', 'CYSTEINESULFINIC ACID, (+/-)-', 'Cysteine hydrogen sulfite ester', '3-Sulphinoalanine', 'UNII-UZY4HYK4ZX', 'ADVPTQAUNPRNPO-UHFFFAOYSA-N', '(2R)-2-amino-3-sulfonylpropanoic acid', '2-azaniumyl-3-hydroxy-3-oxopropane-1-sulfinate'] |
110 | 3-Sulfinylpyruvic acid | C3H4O5S | 2-oxo-3-sulfinopropanoic acid | InChI=1S/C3H4O5S/c4-2(3(5)6)1-9(7)8/h1H2,(H,5,6)(H,7,8) | C(C(=O)C(=O)O)S(=O)O | ['3-sulfinylpyruvic acid', '2-oxo-3-sulfinopropanoic acid', '3-Sulfinopyruvate', '3-Sulfinylpyruvate', '3-sulfinyl-pyruvate', '3-sulphinyl-pyruvate', 'b-sulfinyl pyruvate', '2-oxo-3-sulfinopropionic acid'] |
111 | 3-Ureidopropionic acid | C4H8N2O3 | 3-(carbamoylamino)propanoic acid | InChI=1S/C4H8N2O3/c5-4(9)6-2-1-3(7)8/h1-2H2,(H,7,8)(H3,5,6,9) | C(CNC(=O)N)C(=O)O | ['3-Ureidopropionic acid', '3-(carbamoylamino)propanoic acid', 'N-Carbamoyl-beta-alanine', 'ureidopropionic acid', '3-ureidopropionate', '3-ureidopropanoic acid', 'Carbamoyl-beta-Ala-OH', 'beta-Ureidopropionic acid', '3-Ureidopropanoate', 'N-(aminocarbonyl)-beta-alanine', 'Ureidopropionate', 'Carbamoyl-|A-Ala-OH', '3-[(aminocarbonyl)amino]propanoic acid', 'Carbamoyl-b-Ala-OH', '3-UREIDO-PROPIONATE', 'beta-Alanine, N-(aminocarbonyl)-', '.beta.-Alanine, N-(aminocarbonyl)-', '3-Ureidopropionic Acid;', 'URP', '3-(carbamoylamino)propanoate', 'N-Carbamoyl-', 'Ureidopropanoic acid', 'Carbamoyl--Ala-OH', 'beta-Ureidopropionate', 'N-Carbamyl-b-alanine', 'N-carbamoyl-b-alanine', 'N-Carbamyl-beta-alanine', '3-Ureido-Propionic Acid', 'Propanoic acid, 3-ureido-', 'N-Carbamoyl-.beta.-alanine', 'N-(aminocarbonyl)-b-alanine', "N-(aminocarbonyl)-'b-Alanine", 'Ureidopropionic acid (Standard)', 'CARBAMOYL-.BETA.-ALANINE', 'N-(AMINOCARBONYL)-.BETA.-ALANINE', 'PROPANOIC ACID, 3-((AMINOCARBONYL)AMINO)-', 'N-CARBAMYL-BETA-ALANINE; BETA-UREIDOPROPIONATE'] |
112 | 3-Hydroxy-2-oxo-4-phosphonooxybutanoate | C4H6O8P- | 3-hydroxy-2-oxo-4-phosphonooxybutanoate | InChI=1S/C4H7O8P/c5-2(3(6)4(7)8)1-12-13(9,10)11/h2,5H,1H2,(H,7,8)(H2,9,10,11)/p-1 | C(C(C(=O)C(=O)[O-])O)OP(=O)(O)O | [] |
113 | 3-Hydroxy-2-oxo-4-phosphonooxybutanoic acid | C4H7O8P | 3-hydroxy-2-oxo-4-phosphonooxybutanoic acid | InChI=1S/C4H7O8P/c5-2(3(6)4(7)8)1-12-13(9,10)11/h2,5H,1H2,(H,7,8)(H2,9,10,11) | C(C(C(=O)C(=O)O)O)OP(=O)(O)O | [] |
114 | 3-Pyridinebutanoic acid | C9H11NO2 | 4-pyridin-3-ylbutanoic acid | InChI=1S/C9H11NO2/c11-9(12)5-1-3-8-4-2-6-10-7-8/h2,4,6-7H,1,3,5H2,(H,11,12) | C1=CC(=CN=C1)CCCC(=O)O | ['3-pyridinebutanoic acid', '4-(pyridin-3-yl)butanoic acid', '4-pyridin-3-ylbutanoic acid', '3-Pyridinebutanoate', '4-Pyridin-3-ylbutanoate', '4-3-Pyridyl-butanoic acid', '4-(3-pyridyl)-butanoic acid', '4-3-PYRIDYL-BUTANOATE', '4-(3-pyridyl)-butanoate', '4-pyridin-3-yl-butyric acid', '3-pyridine butanoic acid', '4-(Pyridin-3-yl)butanoate', '4-(3-pyridyl)-butyric acid', '4-(pyridin-3-yl)butanoicacid', '4-(3-pyridil)-butanoic Acid', 'MFYZACBRKCFXDV-UHFFFAOYSA-N'] |
115 | (5-Amino-3,4-dihydroxyoxan-2-yl) dihydrogen phosphate | C5H12NO7P | (5-amino-3,4-dihydroxyoxan-2-yl) dihydrogen phosphate | InChI=1S/C5H12NO7P/c6-2-1-12-5(4(8)3(2)7)13-14(9,10)11/h2-5,7-8H,1,6H2,(H2,9,10,11) | C1C(C(C(C(O1)OP(=O)(O)O)O)O)N | [] |
116 | (3R,4R)-4-amino-3-[(1-carboxyeth-1-en-1-yl)oxy]cyclohexa-1,5-diene-1-carboxylic acid | C10H11NO5 | 4-amino-3-(1-carboxyethenoxy)cyclohexa-1,5-diene-1-carboxylic acid | InChI=1S/C10H11NO5/c1-5(9(12)13)16-8-4-6(10(14)15)2-3-7(8)11/h2-4,7-8H,1,11H2,(H,12,13)(H,14,15) | C=C(C(=O)O)OC1C=C(C=CC1N)C(=O)O | ['(3R,4R)-4-amino-3-[(1-carboxyeth-1-en-1-yl)oxy]cyclohexa-1,5-diene-1-carboxylic acid'] |
117 | 5-amino-1H-imidazole-4-carboxylic acid | C4H5N3O2 | 4-amino-1H-imidazole-5-carboxylic acid | InChI=1S/C4H5N3O2/c5-3-2(4(8)9)6-1-7-3/h1H,5H2,(H,6,7)(H,8,9) | C1=NC(=C(N1)C(=O)O)N | ['5-amino-1H-imidazole-4-carboxylic acid', '4-amino-1H-imidazole-5-carboxylic acid', '5-aminoimidazole-4-carboxylic acid', '5-amino-4-imidazole carboxylate', '4-Amino-5-imidazolecarboxylic acid', '5-AMINO-1H-IMIDAZOLE-4-CARBOXYLICACID', '4-aminoimidazole-5-carboxylate', '5-aminoimidazole-4-carboxylate', '4-amino-imidazole-5-carboxylic acid'] |
118 | 4-Aminobutanal | C4H9NO | 4-aminobutanal | InChI=1S/C4H9NO/c5-3-1-2-4-6/h4H,1-3,5H2 | C(CC=O)CN | ['4-aminobutanal', '4-aminobutyraldehyde', 'Butanal, 4-amino-', 'gamma-aminobutyraldehyde', '4-amino-butyraldehyde', 'Butyraldehyde, 4-amino-', '4-amino-butanal', '4-Azanylbutanal', 'VTX8N8R7G2', 'Butanal, 4-amino- (9CI)', 'DZQLQEYLEYWJIB-UHFFFAOYSA-N', 'Butyraldehyde, 4-amino- (6CI,7CI,8CI)'] |
119 | Gamma-Aminobutyric Acid | C4H9NO2 | 4-aminobutanoic acid | InChI=1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7) | C(CC(=O)O)CN | ['4-aminobutyric acid', '4-Aminobutanoic acid', 'gamma-aminobutyric acid', 'GABA', 'Piperidic acid', 'Piperidinic acid', 'Aminalon', 'Gaballon', 'butanoic acid, 4-amino-', 'Gammalon', 'Gammalone', 'Gammasol', 'Mielogen', 'Mielomade', 'Gamarex', 'Gammar', 'Reanal', 'Butyric acid, 4-amino-', 'gamma-amino-n-butyric acid', 'Immu-G', 'gamma-Aminobutanoic acid', 'Gammagee', 'Gamulin', '.gamma.-Aminobutyric acid', 'omega-Aminobutyric acid', 'Aminalone', 'Gamastan', 'gamma-Amino butyric acid', 'gamma-Aminobuttersaeure', 'gamma-aminobutyrate', '3-Carboxypropylamine', 'GAMMA-AMINO-BUTANOIC ACID', '4-aminobutyrate', '4-aminobutanoate', '4-amino-butanoic acid', 'gamma Aminobutyric acid', '4Abu', '4-amino butyric acid', '4-Amino-butyric acid', 'Gamma-aminobutyric acid [JAN]', '4-amino-n-butyric acid', 'GAMMA(AMINO)-BUTYRIC ACID', 'UNII-2ACZ6IPC6I', '2ACZ6IPC6I', 'Aminobutyric acid, gamma-', 'Factor I', 'Aminobutanoic acid', '.gamma.-Amino-butyric acid', '.gamma.-Amino-N-butyric acid', 'gamma-Aminobutryic acid', '4-NH2-but', '4-NH3-but', '.gamma.-Aminobutanoic acid', '[3H]GABA', 'gamma-Aminobutyric acid (JAN)', 'Butanoic acid, 4-amino- (9CI)', '4-Aminobutylate', 'Butyric acid, 4-amino- (7CI,8CI)', '4-AMINO-BUTYRATE', 'WLN: Z3VQ', '4-Aminobutyricacid', 'BUTANOIC ACID,4-AMINO', 'GAMMA-AMINOBUTYRIC ACID (MART.)', 'GAMMA-AMINOBUTYRIC ACID [MART.]', 'GAMMA-AMINOBUTYRIC ACID (USP-RS)', 'GAMMA-AMINOBUTYRIC ACID [USP-RS]', 'g-Aminobutyric acid', 'Chemical Name: .gamma.-Aminobutanoic acid', '4 Aminobutyric Acid', '4 Aminobutanoic Acid', 'gamma-Aminobuttersaeure [German]', 'Acide amino-4- butyrique [French]', 'Acide amino-4- butyrique', 'aminobutyrate', 'Immuglobin', 'Piperidate', 'Piperidinate', 'w-Aminobutyrate', '4-Aminobutyric', 'GABA Phenolic', 'Gamma aminobutyrate', 'omega-Aminobutyrate', 'Gammalon (TN)', 'a-Aminobutyric acid', 'w-Aminobutyric acid', 'gamma-Aminobuttersaure', 'Vigabatrin impurity D', 'gamma-aminobutyric-acid', 'Aminobutyric acid,-4-', 'gamma-amino-butyric acid', 'gamma.-aminobutyric acid', 'Acide amino-4-butyrique', '4-Amino-n-butanoic acid', 'Vigabatrin EP Impurity D', '.omega.-Aminobutyric acid', 'Gamma-Aminobutyric Acid,(S)', 'NH2-(CH2)3-COOH', 'Gaba (Gamma-Aminobutyric Acid)', '4-AMINOBUTYRIC ACID [FHFI]', '4-amino-n-[2,3-3H]butyric acid', '.GAMMA.-AMINOBUTYRIC ACID [MI]', 'GAMMA-AMINOBUTYRIC ACID [WHO-DD]', 'gamma-Aminobutyric acid, analytical standard', 'VIGABATRIN IMPURITY D [EP IMPURITY]', 'gamma-Aminobutyric acid (4-Aminobutyric acid)', '4-aminobutanoic acid (gamma-aminobutyric acid)', 'Vigabatrin impurity, .gamma.-aminobutyric acid-', 'BUTANOIC ACID,4-AMINO 4-AMINO,BUTYRIC ACID', 'HYDROCODONE, ACETAMINOPHEN, gamma-AMINOBUTYRIC ACID', 'SODIUM ALENDRONATE TRIHYDRATE IMPURITY A [EP IMPURITY]', 'gamma-Aminobutyric acid pound>>(c)(3/4)?Aminobutyric acid (GABA)', 'gamma-Aminobutyric acid, certified reference material, TraceCERT(R)', 'InChI=1/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7', 'VIGABATRIN IMPURITY, gamma-AMINOBUTYRIC ACID-(USP IMPURITY)', 'Vigabatrin impurity D, European Pharmacopoeia (EP) Reference Standard', 'VIGABATRIN IMPURITY, .GAMMA.-AMINOBUTYRIC ACID- [USP IMPURITY]', 'gamma-Aminobutyric acid, United States Pharmacopeia (USP) Reference Standard'] |
120 | 4-Carboxymethylenebut-2-en-4-olide | C6H4O4 | 2-(5-oxofuran-2-ylidene)acetic acid | InChI=1S/C6H4O4/c7-5(8)3-4-1-2-6(9)10-4/h1-3H,(H,7,8) | C1=CC(=O)OC1=CC(=O)O | ['2-(5-oxofuran-2-ylidene)acetic acid', '4-carboxymethylenebut-2-en-4-olide', '2-(5-Oxo-2(5H)-furanylidene)acetic acid'] |
121 | 4-Diphosphocytidyl-2-C-methyl-D-erythritol (CDP-ME) | C14H25N3O14P2 | [[5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] (2,3,4-trihydroxy-3-methylbutyl) hydrogen phosphate | InChI=1S/C14H25N3O14P2/c1-14(23,6-18)8(19)5-29-33(26,27)31-32(24,25)28-4-7-10(20)11(21)12(30-7)17-3-2-9(15)16-13(17)22/h2-3,7-8,10-12,18-21,23H,4-6H2,1H3,(H,24,25)(H,26,27)(H2,15,16,22) | CC(CO)(C(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=CC(=NC2=O)N)O)O)O)O | ['4-Diphosphocytidyl-2-C-methyl-D-erythritol (CDP-ME)'] |
122 | 4,6-Dioxooct-2-enedioic acid | C8H8O6 | 4,6-dioxooct-2-enedioic acid | InChI=1S/C8H8O6/c9-5(1-2-7(11)12)3-6(10)4-8(13)14/h1-2H,3-4H2,(H,11,12)(H,13,14) | C(C(=O)CC(=O)O)C(=O)C=CC(=O)O | ['4,6-dioxooct-2-enedioic acid', '(2Z)4,6-DIOXOOCT-2-ENEDIOIC ACID'] |
123 | Tiformin | C5H12N4O | 4-(diaminomethylideneamino)butanamide | InChI=1S/C5H12N4O/c6-4(10)2-1-3-9-5(7)8/h1-3H2,(H2,6,10)(H4,7,8,9) | C(CC(=O)N)CN=C(N)N | ['Tiformin', '4-Guanidinobutanamide', '4-guanidinobutyramide', '4-carbamimidamidobutanamide', 'Tiformina', 'Tiformine', 'Tiforminum', '4-(diaminomethylideneamino)butanamide', 'Tiformin [INN]', 'TYFORMIN', 'Tiformin [INN:BAN]', 'FZN0LJN8CC', 'UNII-FZN0LJN8CC', 'Tiformine [INN-French]', 'Tiforminum [INN-Latin]', 'Tiformina [INN-Spanish]', '4-(carbamimidamido)butanamide', '4-guanidobutanamide', 'Tiformine (INN-French)', 'Tiforminum (INN-Latin)', 'Tiformina (INN-Spanish)', '4-guanido-butyramide'] |
124 | 4-Hydroxy-2-oxopentanoic acid | C5H8O4 | 4-hydroxy-2-oxopentanoic acid | InChI=1S/C5H8O4/c1-3(6)2-4(7)5(8)9/h3,6H,2H2,1H3,(H,8,9) | CC(CC(=O)C(=O)O)O | ['4-Hydroxy-2-oxopentanoic acid', '4-Hydroxy-2-oxovalerate', 'Q7M6F8F7B9', '4-hydroxy-2-oxovaleric acid', 'UNII-Q7M6F8F7B9', 'Pentanoic acid, 4-hydroxy-2-oxo-', 'VALERIC ACID, 4-HYDROXY-2-OXO-', '4-Hydroxy-2-oxovaleric Acid Potassium Salt'] |
125 | 4-Hydroxybenzyl alcohol | C7H8O2 | 4-(hydroxymethyl)phenol | InChI=1S/C7H8O2/c8-5-6-1-3-7(9)4-2-6/h1-4,8-9H,5H2 | C1=CC(=CC=C1CO)O | ['4-hydroxybenzyl alcohol', '4-(Hydroxymethyl)phenol', 'p-Hydroxybenzyl alcohol', 'p-Methylolphenol', '4-Hydroxybenzenemethanol', '4-Methylolphenol', 'Benzenemethanol, 4-hydroxy-', '4-Hydroxybenzylalcohol', 'p-(Hydroxymethyl)phenol', 'Benzyl alcohol, p-hydroxy-', 'Gastrodigenin', 'alpha-Hydroxy-p-cresol', 'Parahydroxybenzyl Alcohol', '.alpha.-Hydroxy-p-cresol', '1A3AH1FP1B', '4-Hydroxymethyl-phenol', 'p-hydroxy benzyl alcohol', '(4-Hydroxyphenyl)methanol', 'UNII-1A3AH1FP1B', 'a-hydroxy-p-cresol', '4-hydroxymethylphenol', 'p-Hydroxybenzyl alcoho', '4-hydroxymethyl phenol', '4-hydroxybenzyl-alcohol', '4-Hydroxy-benzylalcohol', '4-Hydroxyphenyl methanol', 'p-hydroxy-Benzyl alcohol', '4-Hydroxyphenyl Carbinol', '4-hydroxy benzyl alcohol', '4-hydroxy-benzyl alcohol', '4HBA', 'B4-hydroxy-enzenemethanol', 'para-hydroxybenzyl alcohol', '4-hydroxyl-benzyl alcohol', 'phenol, 4-hydroxymethyl-', 'Benzyl alcohol, p-hydroxy- (8CI)', 'Benzenemethanol, 4-hydroxy- (9CI)', '4-HYDROXYBENZYL ALCOHOL [FHFI]', '4-(hydroxymethyl)phenol (ACD/Name 4.0)', '4-Hydroxybenzyl alcohol, analytical standard', '4-(Hydroxymethyl)phenol;p-Hydroxybenzyl alcohol;p-Methylolphenol', 'InChI=1/C7H8O2/c8-5-6-1-3-7(9)4-2-6/h1-4,8-9H,5H'] |
126 | 4-Hydroxybenzaldehyde | C7H6O2 | 4-hydroxybenzaldehyde | InChI=1S/C7H6O2/c8-5-6-1-3-7(9)4-2-6/h1-5,9H | C1=CC(=CC=C1C=O)O | ['4-hydroxybenzaldehyde', 'p-Hydroxybenzaldehyde', '4-Formylphenol', 'Benzaldehyde, 4-hydroxy-', 'p-Formylphenol', 'p-Oxybenzaldehyde', 'Parahydroxybenzaldehyde', '4-HYDROXY-BENZALDEHYDE', '4-Hydroxy benzaldehyde', 'Benzaldehyde, p-hydroxy-', 'USAF M-6', '4-formyl phenol', 'Para-Hydroxybenzaldehyde', '4-Hydroxybenzenecarbonal', 'Hydroxybenzaldehyde', '4hydroxybenzaldehyde', 'p-Hydroxy-benzaldehyde', 'P-HYDROXYBENZALDEHYDE [MI]', '4-HYDROXYBENZALDEHYDE [FHFI]', 'formylphenol', 'pFormylphenol', 'pOxybenzaldehyde', '4Formylphenol', 'PARA-HYDROXY BENZALDEHYDE', '4-formyl-phenol', 'p-hydroxibezaldehyde', 'p-hydroxybenzaldehye', '4-hydoxybenzaldehyde', '4-hydroxybenzaldehyd', '4-hydroxybezaldehyde', '4-Hydroxybenzaldehye', '4-hydroxibenzaldehyde', '4-hydroxylbenzaldehyde', 'p-hydroxy benzaldehyde', 'Benzaldehyde, phydroxy', '4--hydroxybenzaldehyde', 'p-hydroxyl benzaldehyde', 'Benzaldehyde, 4hydroxy', '4-hydroxyl benzaldehyde', '4-hydroxy- benzaldehyde', 'WLN: VHR DQ', 'p-Hydroxybenzaldehyde, Pract.', 'p-Hydroxybenzaldehyde (Standard)', 'HYDROXYBENZALDEHYDE [INCI]', '4-Hydroxybenzaldehyde, analytical standard', 'BISOPROLOL FUMARATE IMPURITY S [EP IMPURITY]', 'p-Hydroxybenzaldehyde;4-Formylphenol;p-Formylphenol;Bisoprolol Fumarate EP Impurity S'] |
127 | 4-Hydroxyphenylacetic acid | C8H8O3 | 2-(4-hydroxyphenyl)acetic acid | InChI=1S/C8H8O3/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11) | C1=CC(=CC=C1CC(=O)O)O | ['4-hydroxyphenylacetic acid', '2-(4-hydroxyphenyl)acetic acid', 'p-hydroxyphenylacetic acid', '(4-Hydroxyphenyl)acetic acid', 'benzeneacetic acid, 4-hydroxy-', '4-Hydroxybenzeneacetic acid', '4-hydroxyphenylacetate', '(p-Hydroxyphenyl)acetic acid', 'Parahydroxy phenylacetic acid', '4-Carboxymethylphenol', 'Acetic acid, (p-hydroxyphenyl)-', 'p-hydroxyphenylacetate', 'Parahydroxy phenylacetate', '3J9SHG0RCN', 'p-Hydroxyphenyl acetic acid', '4-hydroxyphenyl-acetic acid', '(4-hydroxy-phenyl)-acetic acid', '4-hydroxybenzeneacetate', '4HP', '(p-hydroxyphenyl)acetate', '2-[4-(hydroxy)phenyl)acetic acid', '4-HPA', '4-Hydroxyphenyl acetic acid', '2-(4-(HYDROXY)PHENYL)ACETIC ACID', '4-(Carboxymethyl)phenol', 'UNII-3J9SHG0RCN', '4-hydroxy phenyl acetic acid', '3pcg', 'HPAA', 'Parahydroxyphenylacetate', '1ai6', '4-Hydroxy-Benzeneacetate', '4-hydroxyphenyacetic acid', '4-hydroxyphenylactic acid', '4-hyroxyphenylacetic acid', '(p-hydroxyphenyl)-Acetate', '4- hydroxyphenylacetic acid', '4-hydroxy-phenylacetic acid', '4-hydroxyphenylethanoic acid', '(4-hydroxy-phenyl)-acetate', 'p-hydroxy phenyl acetic acid', '4-Hydroxy-Benzeneacetic acid', '4-Hydroxybenzene acetic acid', '4-hydroxy-phenyl acetic acid', '(p-hydroxyphenyl)-Acetic acid', '(4-hydroxyphenyl) acetic acid', '(4-hydroxyphenyl)-acetic acid', '(4-hydroxyphenyl)ethanoic acid', 'Acetic acid, 4-hydroxyphenyl-', '(4-Hydroxy-phenyl)-essigsaeure', '4-Hydroxyphenylacetic Acid,(S)', '4-Hydroxyphenylacetic acid (Standard)', '2-(4-Hydroxyphenyl)acetic acidP-hydroxybenzeneacetic acid'] |
128 | 3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid | C6H8N2O3 | 3-(5-oxo-1,4-dihydroimidazol-4-yl)propanoic acid | InChI=1S/C6H8N2O3/c9-5(10)2-1-4-6(11)8-3-7-4/h3-4H,1-2H2,(H,9,10)(H,7,8,11) | C1=NC(C(=O)N1)CCC(=O)O | ['Imidazol-4-one-5-propionic acid', '3-(5-oxo-1,4-dihydroimidazol-4-yl)propanoic acid', '4-imidazolone-5-propanoate', '3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid', '4-imidazolone-5-propionic acid', 'imidazolonepropanoate', '1h-imidazole-4-propanoic acid, 4,5-dihydro-5-oxo-', '4,5-dihydro-4-oxo-5-imidazolepropanoate', '4,5-Dihydro-5-oxo-1H-imidazole-4-propanoic acid', '4,5-dihydro-4-oxo-5-imidazolepropanoic acid', 'imidazolone propionate', 'imidazolone propionic acid', '4-imidazolone-5-propionate', '(S)-3-(5-oxo-4,5-dihydro-3H-imidazol-4-yl)propanoate', 'imidazolonepropanoic acid', 'imidazol-4-one-5-propionate', '4-imidazolone-5-propanoic acid', '3a(5ahydroxya4Haimidazola4ayl)propanoic acid', '4,5-dihydro-5-oxo-1h-imidazole-4-propanoate', '3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoate', '3-(5-oxo-4,5-dihydro-3H-imidazol-4-yl)propanoic acid', '(S)-3-(5-oxo-4,5-dihydro-3H-imidazol-4-yl)propanoic acid'] |
129 | 4-Methylpentanal | C6H12O | 4-methylpentanal | InChI=1S/C6H12O/c1-6(2)4-3-5-7/h5-6H,3-4H2,1-2H3 | CC(C)CCC=O | ['4-methylpentanal', '4-Methylvaleraldehyde', 'isocaproaldehyde', 'Pentanal, 4-methyl-', 'isohexanal', '4-Methyl valeraldehyde', 'Valeraldehyde, 4-methyl-', '4-Methyl-1-pentanal', '4-Methylpentan-1-one', '4-METHYLPENTALDEHYDE', 'isohexana', '4-methyl-pentanal', '4-methyl-Valeraldehyde', '.GAMMA.-METHYLVALERALDEHYDE', 'isocaproaldehyde: 4-methyl-Pentanal'] |
130 | 2-Hydroxy-4-oxobutane-1,2,4-tricarboxylic acid | C7H8O8 | 2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid | InChI=1S/C7H8O8/c8-3(5(11)12)1-7(15,6(13)14)2-4(9)10/h15H,1-2H2,(H,9,10)(H,11,12)(H,13,14) | C(C(=O)C(=O)O)C(CC(=O)O)(C(=O)O)O | ['2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid', '4-carboxy-4-hydroxy-2-oxoadipic acid', '4-carboxy-4-hydroxy-2-oxoadipate', '4-hydroxy-4-carboxymethyl-2-oxoglutaric acid', '2-oxo-4-hydroxy-4-carboxy-adipic acid'] |
131 | 3-[(2-Hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl)amino]propanoic acid | C9H18NO8P | 3-[(2-hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl)amino]propanoic acid | InChI=1S/C9H18NO8P/c1-9(2,5-18-19(15,16)17)7(13)8(14)10-4-3-6(11)12/h7,13H,3-5H2,1-2H3,(H,10,14)(H,11,12)(H2,15,16,17) | CC(C)(COP(=O)(O)O)C(C(=O)NCCC(=O)O)O | ['3-[(2-hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl)amino]propanoic acid', '3-[[(2R)-2-hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl]amino]propanoicacid'] |
132 | 2-[3-[(2-Hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl)amino]propanoylamino]-3-sulfanylpropanoic acid | C12H23N2O9PS | 2-[3-[(2-hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl)amino]propanoylamino]-3-sulfanylpropanoic acid | InChI=1S/C12H23N2O9PS/c1-12(2,6-23-24(20,21)22)9(16)10(17)13-4-3-8(15)14-7(5-25)11(18)19/h7,9,16,25H,3-6H2,1-2H3,(H,13,17)(H,14,15)(H,18,19)(H2,20,21,22) | CC(C)(COP(=O)(O)O)C(C(=O)NCCC(=O)NC(CS)C(=O)O)O | [] |
133 | 4-Trimethylammoniobutanal | C7H16NO+ | trimethyl(4-oxobutyl)azanium | InChI=1S/C7H16NO/c1-8(2,3)6-4-5-7-9/h7H,4-6H2,1-3H3/q+1 | C[N+](C)(C)CCCC=O | ['4-TRIMETHYLAMMONIOBUTANAL', 'gamma-Trimethylaminobutyraldehyde', 'trimethyl(4-oxobutyl)azanium', 'Trimethylaminobutyraldehyde', 'trimethyl-(4-oxobutyl)ammonium', 'N,N,N-trimethyl-4-oxobutan-1-aminium', 'N,N,N-trimethyl-4-oxo-1-Butanaminium', '1-Butanaminium, N,N,N-trimethyl-4-oxo-', 'trimethyl-(4-oxobutyl)azanium', '4-(trimethylamino)butanal', 'gamma-Butyrobetaine aldehyde', '4-(trimethylammonio)butanal', '4-N-trimethylaminobutyraldehyde', '2ZO'] |
134 | 4-Trimethylammoniobutanoate | C7H16NO2+ | 3-carboxypropyl(trimethyl)azanium | InChI=1S/C7H15NO2/c1-8(2,3)6-4-5-7(9)10/h4-6H2,1-3H3/p+1 | C[N+](C)(C)CCCC(=O)O | ['4-TRIMETHYLAMMONIOBUTANOATE', '3-carboxy-N,N,N-trimethylpropan-1-aminium', '3-carboxypropyl(trimethyl)azanium', '1-Propanaminium, 3-carboxy-N,N,N-trimethyl-', '(3-carboxypropyl)trimethylazanium', '4-(trimethylammonio)butanoic acid', 'Deoxycarnitine hydrochloride', '3-carboxypropyl-trimethyl-ammonium', 'NM2', '4c5w', '4-N-trimethylammonium butyrate', '(3-Carboxypropyl)trimethylammonium', 'NM3'] |
135 | 4-Hydroxybenzoic acid | C7H6O3 | 4-hydroxybenzoic acid | InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10) | C1=CC(=CC=C1C(=O)O)O | ['4-HYDROXYBENZOIC ACID', 'p-Hydroxybenzoic acid', '4-Carboxyphenol', 'p-Salicylic acid', 'Benzoic acid, 4-hydroxy-', 'Benzoic acid, p-hydroxy-', 'p-carboxyphenol', 'para-Hydroxybenzoic acid', 'Paraben-acid', '4-Hydroxybenzoesaeure', 'p-Oxybenzoesaure', 'Kyselina 4-hydroxybenzoova', 'p-Oxybenzoesaure [German]', 'parahydroxybenzoic acid', 'Acido p-idrossibenzoico', '4-hydroxy-benzoic acid', 'Hydroxybenzoic acid', 'Acido p-idrossibenzoico [Italian]', 'Kyselina 4-hydroxybenzoova [Czech]', 'HYDROXYBENZOIC ACID, PARA', 'p-hydroxy benzoic acid', 'p-hydroxy-Benzoic acid', 'Benzoic acid, 4-hydroxy', 'Hydroxybenzenecarboxylic acid', '4-HBA', '3pcc', '3pch', '4-hydroxy-benzoate', '4-hydroxy benzoic acid', '4-Hydroxybenzoicacid', 'Benzoic acid, p-hydroxy', 'WLN: QVR DQ', 'PHB', 'SALICYLIC ACID IMPURITY A (EP IMPURITY)', 'SALICYLIC ACID IMPURITY A [EP IMPURITY]', 'ACETYLSALICYLIC ACID IMPURITY A (EP IMPURITY)', 'ACETYLSALICYLIC ACID IMPURITY A [EP IMPURITY]', 'PROPYL HYDROXYBENZOATE IMPURITY A (EP IMPURITY)', 'PROPYL HYDROXYBENZOATE IMPURITY A [EP IMPURITY]', 'METHYL PARAHYDROXYBENZOATE IMPURITY A (EP IMPURITY)', 'METHYL PARAHYDROXYBENZOATE IMPURITY A [EP IMPURITY]', 'p-Salicylate', 'p-hydroxy-Benzoate', '4-hydoxybenzoic acid', '4-hyroxybenzoic acid', 'phenol derivative, 8', '4-hydroxylbenzoic acid', '4-Hydroxy-benzoesaeure', '4-hydroxybenzoi c acid', '4-hydroxyl benzoic acid', '4-Hydroxybenzoate, III', 'para-hydroxy benzoic acid', '4-Hydroxybenzenecarboxylic acid', 'p-Hydroxybenzoic Acid, Reagent', '4-Hydroxybenzoic acid (Standard)', 'P-HYDROXYBENZOIC ACID [MI]', '4-HYDROXYBENZOIC ACID [FHFI]', '4-HYDROXYBENZOIC ACID [HSDB]', '4-Hydroxybenzoic acid, certified reference material, TraceCERT(R)', '4-Hydroxybenzoic acid, Pharmaceutical Secondary Standard; Certified Reference Material'] |
136 | CID 136 | C20H22N7O6+ | 2-[[4-(3-amino-1-oxo-5,6,6a,7-tetrahydro-4H-imidazo[1,5-f]pteridin-10-ium-8-yl)benzoyl]amino]pentanedioic acid | InChI=1S/C20H21N7O6/c21-20-24-16-15(18(31)25-20)27-9-26(8-12(27)7-22-16)11-3-1-10(2-4-11)17(30)23-13(19(32)33)5-6-14(28)29/h1-4,9,12-13H,5-8H2,(H6-,21,22,23,24,25,28,29,30,31,32,33)/p+1 | C1C2CN(C=[N+]2C3=C(N1)NC(=NC3=O)N)C4=CC=C(C=C4)C(=O)NC(CCC(=O)O)C(=O)O | [] |
137 | Aminolevulinic Acid | C5H9NO3 | 5-amino-4-oxopentanoic acid | InChI=1S/C5H9NO3/c6-3-4(7)1-2-5(8)9/h1-3,6H2,(H,8,9) | C(CC(=O)O)C(=O)CN | ['5-Aminolevulinic acid', 'Aminolevulinic acid', '5-Amino-4-oxopentanoic acid', '5-Aminolevulinate', 'Pentanoic acid, 5-amino-4-oxo-', 'delta-aminolevulinic acid', 'Aladerm', '5-Amino-4-oxovaleric acid', '5-ALA', 'Aminolevulinate', 'Kerastick', 'delta-ALA', '5-amino-4-oxo-pentanoic acid', '5-Aminolaevulinic acid', '5-amino-levulinate', 'Levulinic acid, 5-amino-', 'D-aminolevulinic acid', '5-amino-levulinic acid', '5-Amino-4-oxopentanoate', 'Amino-levulinic acid', 'DALA', '.delta.-aminolevulinic acid', '4-oxo-5-amino-pentanoic acid', '5-azanyl-4-oxidanylidene-pentanoic acid', 'delta-aminolevulinate', 'Aminolevulinic', '5-AMINOLEVULINIC ACID (MART.)', '5-AMINOLEVULINIC ACID [MART.]', '5-Aminolaevulinate', 'Acid, Aminolevulinic', 'Delta Aminolevulinic Acid', 'Acid, Delta-Aminolevulinic', 'FVT', '5-aminolevulinic-acid', 'd-amino-levulinic acid', 'acido 5-aminolevulinico', '5-Amino-4-oxovalerate', '5-amino-4-oxo-Pentanoate', 'AMINOLEVULINIC ACID [VANDF]', 'Levulinic acid, 5-amino- (8CI)', 'AMINOLEVULINIC ACID [WHO-DD]', '.DELTA.-AMINOLEVULINIC ACID [MI]', 'Pentanoic acid, 5-amino-4-oxo- (9CI)', 'METHYLAMINOLEVULINATE HYDROCHLORIDE IMPURITY B [EP IMPURITY]'] |
138 | 5-Aminovaleric acid | C5H11NO2 | 5-aminopentanoic acid | InChI=1S/C5H11NO2/c6-4-2-1-3-5(7)8/h1-4,6H2,(H,7,8) | C(CCN)CC(=O)O | ['5-Aminovaleric acid', '5-Aminopentanoic acid', 'Homopiperidinic acid', 'Pentanoic acid, 5-amino-', 'H-5-Ava-OH', '5-amino-pentanoic acid', 'Valeric acid, 5-amino-', 'delta-Amino-n-valeric acid', 'delta-Aminovaleric acid', '5-aminopentanoate', 'DAVA', '5-AMINO-N-VALERIC ACID', '5-aminovalerate', '5-ammoniopentanoate', '.delta.-Aminovaleric acid', 'Delta-Aminovalerianic Acid', '.delta.-Amino-n-valeric acid', 'delta-aminovalerate', 'delta-Amino-n-valerate', 'Valeric acid, 5-amino- (8CI)', 'Pentanoic acid, 5-amino- (9CI)', '5-Aminopentanoicacid', 'DANVA', '5-amino valeric acid', '5-amino-valeric acid', 'omega-aminovaleric acid', '5-Amino pentanoic acid', 'BUW4BFJ6SC', 'delta-aminopentanoic acid', 'omega-Aminopentanoic acid', '5-amino-n-pentanoic acid', 'H2N(CH2)4COOH', 'Valeric acid, (5-amino)-'] |
139 | 10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol | C27H48O3 | 10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol | InChI=1S/C27H48O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(15-24(30)27(20,21)5)26(4)12-11-19(28)13-18(26)14-23(25)29/h16-25,28-30H,6-15H2,1-5H3 | CC(C)CCCC(C)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C | [] |
140 | 27-Deoxy-5alpha-cyprinol | C27H48O4 | 17-(7-hydroxy-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol | InChI=1S/C27H48O4/c1-16(15-28)6-5-7-17(2)20-8-9-21-25-22(14-24(31)27(20,21)4)26(3)11-10-19(29)12-18(26)13-23(25)30/h16-25,28-31H,5-15H2,1-4H3 | CC(CCCC(C)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C)CO | [] |
141 | (3,4-Dihydroxy-5-oxooxan-2-yl) [[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate | C14H20N2O16P2 | (3,4-dihydroxy-5-oxooxan-2-yl) [[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate | InChI=1S/C14H20N2O16P2/c17-5-3-28-13(11(22)8(5)19)31-34(26,27)32-33(24,25)29-4-6-9(20)10(21)12(30-6)16-2-1-7(18)15-14(16)23/h1-2,6,8-13,19-22H,3-4H2,(H,24,25)(H,26,27)(H,15,18,23) | C1C(=O)C(C(C(O1)OP(=O)(O)OP(=O)(O)OCC2C(C(C(O2)N3C=CC(=O)NC3=O)O)O)O)O | [] |
142 | 9H-Purin-6-amine, 9-(5-deoxy-alpha-D-xylofuranosyl)- | C10H13N5O3 | 2-(6-aminopurin-9-yl)-5-methyloxolane-3,4-diol | InChI=1S/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13) | CC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O | ['9H-Purin-6-amine, 9-(5-deoxy-.alpha.-D-xylofuranosyl)-', "5\\'-deoxyadenosine", '1H-Purin-6-amine,9-(5-deoxy-b-D-xylofuranosyl)- (9CI)', '9-(5-deoxypentofuranosyl)-9H-purin-6-amine', '2-(6-Amino-purin-9-yl)-5-methyl-tetrahydro-furan-3,4-diol'] |
143 | CID 143 | C20H23N7O7 | 2-[[4-[(2-amino-5-formyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid | InChI=1S/C20H23N7O7/c21-20-25-16-15(18(32)26-20)27(9-28)12(8-23-16)7-22-11-3-1-10(2-4-11)17(31)24-13(19(33)34)5-6-14(29)30/h1-4,9,12-13,22H,5-8H2,(H,24,31)(H,29,30)(H,33,34)(H4,21,23,25,26,32) | C1C(N(C2=C(N1)NC(=NC2=O)N)C=O)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O | [] |
144 | 5-Hydroxytryptophan | C11H12N2O3 | 2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoic acid | InChI=1S/C11H12N2O3/c12-9(11(15)16)3-6-5-13-10-2-1-7(14)4-8(6)10/h1-2,4-5,9,13-14H,3,12H2,(H,15,16) | C1=CC2=C(C=C1O)C(=CN2)CC(C(=O)O)N | ['5-hydroxytryptophan', 'DL-5-Hydroxytryptophan', '5-Hydroxy-DL-tryptophan', '2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoic acid', '5-HTP', 'DL-Hydroxytryptophan', '(+-)-5-Hydroxytryptophan', 'DL-5-HTP', '5-Hydroxytryptophan DL-form', '5-hydroxy tryptophan', '(+/-)-5-Hydroxytryptophan', 'hydroxytryptophan', '5-hydroxytryptophan (5-HTP)', 'DL-Pretonine', 'Dl-oxitriptan', 'H-L-Trp(5-OH)-OH', '5-hydroxytryptophan, dl-', '5-Hydroxytryptophan L form', 'Tryptophan, 5-hydroxy-, dl', 'D,L-5-hydroxytryptophan', 'Tryptophan, 5-hydroxy-, L-', 'DL-Tryptophan, 5-hydroxy-', '5-Hydroxytryptophan #', '5-HTP/5-Hydroxytryptophan', '2-Amino-3-(5-hydroxy-1H-indol-3-yl)propanoicacid', '(.+-.)-5-Hydroxytryptophan', '5-Hydroxytryptophan, AldrichCPR', '5-HYDROXYTRYPTOPHAN [MI]', '5-HYDROXYTRYPTOPHAN [HSDB]', 'DL-2-Amino-3-(5-hydroxyindolyl)propionic acid', 'propanoic acid, 2-amino-3-(5-hydroxyindol-3-yl)-'] |
145 | 2,3-Dihydroxy-5-oxohexanedioic acid | C6H8O7 | 2,3-dihydroxy-5-oxohexanedioic acid | InChI=1S/C6H8O7/c7-2(4(9)6(12)13)1-3(8)5(10)11/h2,4,7,9H,1H2,(H,10,11)(H,12,13) | C(C(C(C(=O)O)O)O)C(=O)C(=O)O | [] |
146 | CID 146 | C20H25N7O6 | 2-[[4-[(2-amino-5-methyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid | InChI=1S/C20H25N7O6/c1-27-12(9-23-16-15(27)18(31)26-20(21)25-16)8-22-11-4-2-10(3-5-11)17(30)24-13(19(32)33)6-7-14(28)29/h2-5,12-13,22H,6-9H2,1H3,(H,24,30)(H,28,29)(H,32,33)(H4,21,23,25,26,31) | CN1C(CNC2=C1C(=O)N=C(N2)N)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O | [] |
147 | CID 147 | C11H17N3O5Se | 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(methylaminomethyl)-2-selanylpyrimidin-4-one | InChI=1S/C11H17N3O5Se/c1-12-2-5-3-14(11(20)13-9(5)18)10-8(17)7(16)6(4-15)19-10/h3,6-8,10,12,15-17H,2,4H2,1H3,(H,13,18,20) | CNCC1=CN(C(=NC1=O)[SeH])C2C(C(C(O2)CO)O)O | [] |
148 | CID 148 | C11H17N3O5S | 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(methylaminomethyl)-2-sulfanylpyrimidin-4-one | InChI=1S/C11H17N3O5S/c1-12-2-5-3-14(11(20)13-9(5)18)10-8(17)7(16)6(4-15)19-10/h3,6-8,10,12,15-17H,2,4H2,1H3,(H,13,18,20) | CNCC1=CN(C(=NC1=O)S)C2C(C(C(O2)CO)O)O | [] |
149 | beta-D-Ribofuranose, 1-(6-amino-9H-purin-9-yl)-1-deoxy-5-S-methyl-5-thio- | C11H15N5O3S | 2-(6-aminopurin-9-yl)-5-(methylsulfanylmethyl)oxolane-3,4-diol | InChI=1S/C11H15N5O3S/c1-20-2-5-7(17)8(18)11(19-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14) | CSCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O | ['2-(6-aminopurin-9-yl)-5-(methylsulfanylmethyl)oxolane-3,4-diol', 'beta-D-Ribofuranose, 1-(6-amino-9H-purin-9-yl)-1-deoxy-5-S-methyl-5-thio-', "5'-CH3S-xyloA", '(+/-)-p-ethoxybenzoin', '.beta.-D-Ribofuranose, 1-(6-amino-9H-purin-9-yl)-1-deoxy-5-S-methyl-5-thio-', '9-(5-s-methyl-5-thiopentofuranosyl)-9h-purin-6-amine', 'Adenosine + C2H5S', "5\\'-S-methyl-5\\'-thioadenosine", "9-(5'-Deoxy-5'-(methylthio)-beta-D-xylofuranosyl)-adenine", '2-(6-aminopurin-9-yl)-5-(methylsulanylmethyl)oxolane-3,4-diol', '(2R,5S)-2-(6-Aminopurin-9-yl)-5-(methylsulfanylmethyl)oxolane-3,4-diol'] |
150 | Phosphoribosylamine | C5H12NO7P | (5-amino-3,4-dihydroxyoxolan-2-yl)methyl dihydrogen phosphate | InChI=1S/C5H12NO7P/c6-5-4(8)3(7)2(13-5)1-12-14(9,10)11/h2-5,7-8H,1,6H2,(H2,9,10,11) | C(C1C(C(C(O1)N)O)O)OP(=O)(O)O | ['Phosphoribosylamine', '5-phospho-b-D-Ribosylaminium(1-)', '(5-amino-3,4-dihydroxyoxolan-2-yl)methyl dihydrogen phosphate'] |
151 | Phosphoribosyl-N-formylglycineamide | C8H15N2O9P | [5-[(2-formamidoacetyl)amino]-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate | InChI=1S/C8H15N2O9P/c11-3-9-1-5(12)10-8-7(14)6(13)4(19-8)2-18-20(15,16)17/h3-4,6-8,13-14H,1-2H2,(H,9,11)(H,10,12)(H2,15,16,17) | C(C1C(C(C(O1)NC(=O)CNC=O)O)O)OP(=O)(O)O | ['Phosphoribosyl-N-formylglycineamide'] |
152 | n-Glycyl-5-o-phosphonopentofuranosylamine | C7H15N2O8P | [5-[(2-aminoacetyl)amino]-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate | InChI=1S/C7H15N2O8P/c8-1-4(10)9-7-6(12)5(11)3(17-7)2-16-18(13,14)15/h3,5-7,11-12H,1-2,8H2,(H,9,10)(H2,13,14,15) | C(C1C(C(C(O1)NC(=O)CN)O)O)OP(=O)(O)O | ['N-(Aminoacetyl)-5-O-phosphonopentofuranosylamine', 'n-glycyl-5-o-phosphonopentofuranosylamine', '[5-[(2-Aminoacetyl)Amino]-3,4-Dihydroxy-Oxolan-2-Yl]Methoxyphosphonic Acid', '[5-[(2-Aminoacetyl)amino]-3,4-dihydroxyoxolan-2-yl]methyl dihydrogenphosphate', '[5-[(2-aminoacetyl)amino]-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate'] |
153 | 1-(5-o-Phosphonopentofuranosyl)-1h-imidazol-5-amine | C8H14N3O7P | [5-(5-aminoimidazol-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate | InChI=1S/C8H14N3O7P/c9-5-1-10-3-11(5)8-7(13)6(12)4(18-8)2-17-19(14,15)16/h1,3-4,6-8,12-13H,2,9H2,(H2,14,15,16) | C1=C(N(C=N1)C2C(C(C(O2)COP(=O)(O)O)O)O)N | ['{[5-(5-amino-1H-imidazol-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid', '1-(5-o-phosphonopentofuranosyl)-1h-imidazol-5-amine', 'PDACUKOKVHBVHJ-UHFFFAOYSA-N'] |
154 | CID 154 | C8H16N3O8P | [5-[(1-amino-2-formamidoethylidene)amino]-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate | InChI=1S/C8H16N3O8P/c9-5(1-10-3-12)11-8-7(14)6(13)4(19-8)2-18-20(15,16)17/h3-4,6-8,13-14H,1-2H2,(H2,9,11)(H,10,12)(H2,15,16,17) | C(C1C(C(C(O1)N=C(CNC=O)N)O)O)OP(=O)(O)O | [] |
155 | 5-Ureidoimidazole-4-carboxylic acid | C5H6N4O3 | 4-(carbamoylamino)-1H-imidazole-5-carboxylic acid | InChI=1S/C5H6N4O3/c6-5(12)9-3-2(4(10)11)7-1-8-3/h1H,(H,7,8)(H,10,11)(H3,6,9,12) | C1=NC(=C(N1)C(=O)O)NC(=O)N | ['5-ureidoimidazole-4-carboxylic acid', '5-Ureido-4-imidazole carboxylate', '4-Ureido-5-imidazolecarboxylic acid', '4-(carbamoylamino)-1H-imidazole-5-carboxylic acid', '5-(carbamoylamino)-1H-imidazole-4-carboxylic acid', '4-Imidazolecarboxylic acid, 5-ureido-'] |
156 | 5,6,7,8-Tetrahydropteridine | C6H8N4 | 5,6,7,8-tetrahydropteridine | InChI=1S/C6H8N4/c1-2-9-6-5(8-1)3-7-4-10-6/h3-4,8H,1-2H2,(H,7,9,10) | C1CNC2=NC=NC=C2N1 | ['5,6,7,8-tetrahydropteridine', 'tetrahydropteridine', 'H4-biopterin', 'Pteridine, 5,6,7,8-tetrahydro-', '5,6,7,8-tetrahydro-Pteridine', 'Pteridine, 5,6,7,8-tetrahydro- (6CI,7CI,8CI,9CI)', 'PTERIDINE, 1,5,6,7-TETRAHYDRO-'] |
157 | 2,3,4,6-Tetrahydroxy-5-oxohexanoic acid | C6H10O7 | 2,3,4,6-tetrahydroxy-5-oxohexanoic acid | InChI=1S/C6H10O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h3-5,7,9-11H,1H2,(H,12,13) | C(C(=O)C(C(C(C(=O)O)O)O)O)O | ['hex-5-ulosonic acid', '2,3,4,6-tetrahydroxy-5-oxohexanoic acid', '5-keto-D-gluconate', 'D-arabino-5-Hexulosonic acid', 'tagaturonate', '5-k-gluconate', '5-Ketogluconsaure', '5K-GLUCONATE', 'IZSRJDGCGRAUAR-UHFFFAOYSA-N'] |
158 | 8-iso PROSTAGLANDIN E2 | C20H32O5 | 7-[3-hydroxy-2-(3-hydroxyoct-1-enyl)-5-oxocyclopentyl]hept-5-enoic acid | InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-17,19,21,23H,2-3,5-6,8-11,14H2,1H3,(H,24,25) | CCCCCC(C=CC1C(CC(=O)C1CC=CCCCC(=O)O)O)O | ['8-iso PROSTAGLANDIN E2', '7-[3-hydroxy-2-(3-hydroxyoct-1-enyl)-5-oxocyclopentyl]hept-5-enoic acid', '7-(3-hydroxy-2-(3-hydroxyoct-1-enyl)-5-oxocyclopentyl)hept-5-enoic acid', '7-[3-hydroxy-2-(3-hydroxyoct-1-enyl)-5-oxo-cyclopentyl] hepta-5-enoic acid'] |
159 | 5-[5-Hydroxy-4-(3-hydroxyoct-1-enyl)-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-ylidene]pentanoic acid | C20H32O5 | 5-[5-hydroxy-4-(3-hydroxyoct-1-enyl)-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-ylidene]pentanoic acid | InChI=1S/C20H32O5/c1-2-3-4-7-14(21)10-11-16-17-12-15(8-5-6-9-20(23)24)25-19(17)13-18(16)22/h8,10-11,14,16-19,21-22H,2-7,9,12-13H2,1H3,(H,23,24) | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)O2)O)O | [] |
160 | 7-[3,5-Dihydroxy-2-(3-hydroxyoct-1-enyl)cyclopentyl]hept-5-enoic acid | C20H34O5 | 7-[3,5-dihydroxy-2-(3-hydroxyoct-1-enyl)cyclopentyl]hept-5-enoic acid | InChI=1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-19,21-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25) | CCCCCC(C=CC1C(CC(C1CC=CCCCC(=O)O)O)O)O | ['Prostaglandin F2a;PGF2alpha', '7-[3,5-dihydroxy-2-(3-hydroxyoct-1-enyl)cyclopentyl]hept-5-enoic acid', '8-EPI-PROSTAGLANDIN F2a', '7-[3,5-Dihydroxy-2-(3-hydroxy-oct-1-enyl)-cyclopentyl]-hept-5-enoic acid', 'PXGPLTODNUVGFL-UHFFFAOYSA-N', '7-[3,5-dihydroxy-2-(3-hydroxyoct-1-en-1-yl)cyclopentyl]hept-5-enoic acid', '2-amino-2-methylol-propane-1,3-diol;7-[3,5-dihydroxy-2-(3-hydroxyoct-1-enyl)cyclopentyl]hept-5-enoic acid'] |
161 | [[3-(2-amino-4-oxo-4a,7,8,8a-tetrahydro-3H-pteridin-6-yl)-2,3-dihydroxypropoxy]-hydroxyphosphoryl] phosphono hydrogen phosphate | C9H18N5O13P3 | [[3-(2-amino-4-oxo-4a,7,8,8a-tetrahydro-3H-pteridin-6-yl)-2,3-dihydroxypropoxy]-hydroxyphosphoryl] phosphono hydrogen phosphate | InChI=1S/C9H18N5O13P3/c10-9-13-7-5(8(17)14-9)12-3(1-11-7)6(16)4(15)2-25-29(21,22)27-30(23,24)26-28(18,19)20/h4-7,11,15-16H,1-2H2,(H,21,22)(H,23,24)(H2,18,19,20)(H3,10,13,14,17) | C1C(=NC2C(N1)N=C(NC2=O)N)C(C(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O | [] |
162 | 6-Amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid | C8H12N2O3S | 6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid | InChI=1S/C8H12N2O3S/c1-8(2)4(7(12)13)10-5(11)3(9)6(10)14-8/h3-4,6H,9H2,1-2H3,(H,12,13) | CC1(C(N2C(S1)C(C2=O)N)C(=O)O)C | ['6-Amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid', '6-Amino-3,3-dimethyl-7-oxo-4-thia-1-aza- bicyclo[3.2.0]heptane-2-carboxyl', '4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-amino-3,3-dimethyl-7-oxo-', '6-Amino-3,3-dimethyl-7-oxo-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carboxylic acid', '6-Amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid', '6-aminopenicillansaure', '6-AMINO-3,3-DIMETHYL-7-OXO-4-THIA-1-AZA-BICYCLO[3.2.0]HEPTANE-2-CARBOXYL', '6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo [3.2.0]heptane-2-carboxylic acid', '6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]-heptane-2-carboxylic acid', '6-Amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid #', '6-Amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid'] |
163 | 7-[2-[3-[[4-[[[5-(6-Aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-7-oxoheptanoic acid | C28H46N7O19P3S | 7-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-7-oxoheptanoic acid | InChI=1S/C28H46N7O19P3S/c1-28(2,23(41)26(42)31-9-8-17(36)30-10-11-58-19(39)7-5-3-4-6-18(37)38)13-51-57(48,49)54-56(46,47)50-12-16-22(53-55(43,44)45)21(40)27(52-16)35-15-34-20-24(29)32-14-33-25(20)35/h14-16,21-23,27,40-41H,3-13H2,1-2H3,(H,30,36)(H,31,42)(H,37,38)(H,46,47)(H,48,49)(H2,29,32,33)(H2,43,44,45) | CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)CCCCCC(=O)O)O | [] |
164 | 2-Amino-6-diazo-5-oxohexanoic acid | C6H9N3O3 | 2-amino-6-diazo-5-oxohexanoic acid | InChI=1S/C6H9N3O3/c7-5(6(11)12)2-1-4(10)3-9-8/h3,5H,1-2,7H2,(H,11,12) | C(CC(=O)C=[N+]=[N-])C(C(=O)O)N | ['6-Diazo-5-oxo-norleucine', '2-Amino-6-diazo-5-oxohexanoic acid', 'Norleucine, 6-diazo-5-oxo-', 'H-6-Diazo-5-oxo-D-Nle-OH', 'H-6-Diazo-5-oxo-Nle-OH', 'Diazooxonorleucin', 'D-DON;H-D-Glu(diazomethylketone)-OH;6-Diazo-5-oxo-D-2-aminohexanoic acid', 'L-DON;H-Glu(diazomethylketone)-OH;6-Diazo-5-oxo-L-2-aminohexanoic acid', 'DL-Diazooxonorleucine', '6-DIAZO-5-OXO-DL-NORLEUCINE', '(2S)-2-amino-6-diazo-5-oxohexanoic acid;L-Nle(6-Diazo-5-oxo)-OH'] |
165 | 5-Amino-2,6-dihydroxy-6-oxohex-1-ene-1-diazonium | C6H10N3O3+ | 5-amino-2,6-dihydroxy-6-oxohex-1-ene-1-diazonium | InChI=1S/C6H9N3O3/c7-5(6(11)12)2-1-4(10)3-9-8/h3,5H,1-2,7H2,(H-,10,11,12)/p+1 | C(CC(=C[N+]#N)O)C(C(=O)O)N | [] |
166 | 1-(2-amino-4-oxo-4a,5,6,7,8,8a-hexahydro-3H-pteridin-6-yl)propane-1,2-dione | C9H13N5O3 | 1-(2-amino-4-oxo-4a,5,6,7,8,8a-hexahydro-3H-pteridin-6-yl)propane-1,2-dione | InChI=1S/C9H13N5O3/c1-3(15)6(16)4-2-11-7-5(12-4)8(17)14-9(10)13-7/h4-5,7,11-12H,2H2,1H3,(H3,10,13,14,17) | CC(=O)C(=O)C1CNC2C(N1)C(=O)NC(=N2)N | [] |
167 | 6,7-Dihydropteridine | C6H6N4 | 6,7-dihydropteridine | InChI=1S/C6H6N4/c1-2-9-6-5(8-1)3-7-4-10-6/h3-4H,1-2H2 | C1CN=C2C(=N1)C=NC=N2 | ['6,7-dihydropteridine', 'dihydropteridine'] |
168 | Hex6P(?1-4)Hex | C12H23O14P | [3,4,5-trihydroxy-6-[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methyl dihydrogen phosphate | InChI=1S/C12H23O14P/c13-1-3-10(7(16)8(17)11(19)24-3)26-12-9(18)6(15)5(14)4(25-12)2-23-27(20,21)22/h3-19H,1-2H2,(H2,20,21,22) | C(C1C(C(C(C(O1)O)O)O)OC2C(C(C(C(O2)COP(=O)(O)O)O)O)O)O | [] |
169 | 5,12-Dihydroxyicosa-6,8,10,14-tetraenoic acid | C20H32O4 | 5,12-dihydroxyicosa-6,8,10,14-tetraenoic acid | InChI=1S/C20H32O4/c1-2-3-4-5-6-9-13-18(21)14-10-7-8-11-15-19(22)16-12-17-20(23)24/h6-11,14-15,18-19,21-22H,2-5,12-13,16-17H2,1H3,(H,23,24) | CCCCCC=CCC(C=CC=CC=CC(CCCC(=O)O)O)O | [] |
170 | CID 170 | C14H14N6O3 | 4-[(2-amino-4-oxo-7,8-dihydro-1H-pteridin-6-yl)methylamino]benzoic acid | InChI=1S/C14H14N6O3/c15-14-19-11-10(12(21)20-14)18-9(6-17-11)5-16-8-3-1-7(2-4-8)13(22)23/h1-4,16H,5-6H2,(H,22,23)(H4,15,17,19,20,21) | C1C(=NC2=C(N1)NC(=NC2=O)N)CNC3=CC=C(C=C3)C(=O)O | [] |
171 | CID 171 | C7H9N5O | 2-amino-5-(aminomethyl)-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one | InChI=1S/C7H9N5O/c8-1-3-2-10-5-4(3)6(13)12-7(9)11-5/h2H,1,8H2,(H4,9,10,11,12,13) | C1=C(C2=C(N1)NC(=NC2=O)N)CN | [] |
172 | (3beta)-Cholesta-5,7-dien-3-ol | C27H44O | 10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol | InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9-10,18-19,21,23-25,28H,6-8,11-17H2,1-5H3 | CC(C)CCCC(C)C1CCC2C1(CCC3C2=CC=C4C3(CCC(C4)O)C)C | ['(3.beta.)-Cholesta-5,7-dien-3-ol', '.DELTA.7-Cholesterol', '.DELTA.5,7-Cholesterol', '5,7-Cholestandien-3.beta.-ol', 'Cholesta-5,7-dien-3.beta.-ol', 'Cholesta-5,7-dien-3-ol, (3.beta.)-', 'Cholesta-5,7-dien-3-.beta.-ol'] |
173 | 8-Amino-7-oxononanoic acid | C9H17NO3 | 8-amino-7-oxononanoic acid | InChI=1S/C9H17NO3/c1-7(10)8(11)5-3-2-4-6-9(12)13/h7H,2-6,10H2,1H3,(H,12,13) | CC(C(=O)CCCCCC(=O)O)N | ['8-Amino-7-oxononanoic acid', '7-Keto-8-aminopelargonic acid', '8-amino-7-oxononanoate', 'KAPA cpd', '7-oxo-8-amino-nonanoic acid', '8-amino-7-keto-pelargonic acid'] |
174 | Ethylene Glycol | C2H6O2 | ethane-1,2-diol | InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2 | C(CO)O | ['ETHYLENE GLYCOL', 'Ethane-1,2-diol', '1,2-ethanediol', 'glycol', 'monoethylene glycol', '1,2-Dihydroxyethane', '2-hydroxyethanol', 'Glycol alcohol', 'Ethylene alcohol', 'Macrogol', 'Fridex', 'Tescol', 'Ethylene dihydrate', 'Norkool', 'Dowtherm SR 1', 'Zerex', 'Lutrol-9', 'ethanediol', 'ethyleneglycol', 'Aethylenglykol', 'Glycol, ethylene-', '1,2-Ethandiol', '1,2-ethylene glycol', 'Athylenglykol', 'ethylen glycol', 'M.e.g.', 'Lutrol 9', 'NANOSILVER+EG', 'PEG', 'HOCH2CH2OH', '1,2-Ethylene Glycol (Ethylene Glycol)', 'ETHYLENE GLYCOL (II)', 'ETHYLENE GLYCOL [II]', 'ETHYLENE GLYCOL (MART.)', 'ETHYLENE GLYCOL [MART.]', 'Ethylenglycol', 'Aethylenglykol [German]', 'ethylene-glycol', '2 Hydroxyethanol', 'Glycol, Ethylene', 'GLYCEROL IMPURITY B (EP IMPURITY)', 'GLYCEROL IMPURITY B [EP IMPURITY]', 'Glycol, Monoethylene', '1,2-dihydroxy ethane', 'WLN: Q2Q', 'ethyleneglycole', 'ehtylene glycol', 'etylene glycol', '2-ethanediol', 'Ilexan E', 'Solbanon (TN)', '1,2-ethane diol', '1,2-ethane-diol', 'ethane-1.2-diol', 'GXT', '1,2-ethyleneglycol', 'ethan-1,2-diol', 'mono-ethylene glycol', 'Ethane-1,2-diol (Ethylene Glycol)', 'Mono Ethylene Glycol', '1,2-ethylene-glycol', 'Lutrol E (TN)', 'DuPont Zonyl FSO Fluorinated Surfactants', 'Ethylene glycol, aerosol', 'HO-CH2-CH2-OH', 'HO(CH2)2OH', 'ETHYLENE GLYCOL [MI]', 'ETHYLENE GLYCOL [HSDB]', 'ETHYLENE GLYCOL [USP-RS]', 'ETHYLENE GLYCOL [WHO-DD]', '1,2-ETHANEDIOL (GLYCOL)', 'Ethylene Glycol Blank Standard in Multi-grade Diesel Engine Oil', 'Ethylene glycol, analytical standard', 'DuPont Zonyl FSE Fluorinated Surfactants', 'Residual Solvent Class 2 - Ethylene Glycol', '1,2-Ethane-1,1,2,2-d4-diol-d2(9ci)', 'InChI=1/C2H6O2/c3-1-2-4/h3-4H,1-2H', 'Ethylene glycol, United States Pharmacopeia (USP) Reference Standard', 'Ethylene glycol, Pharmaceutical Secondary Standard; Certified Reference Material', 'Residual Solvent Class 2 - Ethylene Glycol, United States Pharmacopeia (USP) Reference Standard'] |
175 | Acetate | C2H3O2- | acetate | InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1 | CC(=O)[O-] | ['acetate', 'Acetate Ion', 'Acetic acid, ion(1-)', 'Acetate ions', 'ethanoate', 'Acetate anion', 'Acetoxy ion', 'Acetate ion (1-)', 'Azetat', 'Acetic acid anion', 'MeCO2 anion', 'CH3-COO(-)', 'Ethanoat', 'Shotgun', 'monoacetate', '(C2 H3 O)2-', 'racemic acetate', 'acetyl hydroxide', 'Acetic cid glacial', 'ACETATE [VANDF]'] |
176 | Acetic Acid | C2H4O2 | acetic acid | InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4) | CC(=O)O | ['acetic acid', 'ethanoic acid', 'Acetic acid glacial', 'Ethylic acid', 'Vinegar acid', 'Glacial acetic acid', 'Acetic acid, glacial', 'Methanecarboxylic acid', 'Essigsaeure', 'Acide acetique', 'Pyroligneous acid', 'Vinegar', 'Azijnzuur', 'Aceticum acidum', 'Acido acetico', 'Octowy kwas', 'Aci-jel', 'HOAc', 'ethoic acid', 'Kyselina octova', 'Orthoacetic acid', 'AcOH', 'Azijnzuur [Dutch]', 'Ethanoic acid monomer', 'Acetic', 'Essigsaeure [German]', 'Otic Tridesilon', 'Octowy kwas [Polish]', 'Acetic acid (natural)', 'Acide acetique [French]', 'Acido acetico [Italian]', 'Kyselina octova [Czech]', 'MeCOOH', 'Otic Domeboro', 'Acidum aceticum glaciale', 'Acidum aceticum', 'CH3-COOH', 'acetic acid-', 'CH3CO2H', 'Acetic acid, diluted', 'Acetic acid [JAN]', 'MeCO2H', 'CH3COOH', 'Ethanoat', 'Shotgun', 'C2:0', 'acetyl alcohol', 'Orlex', 'Vosol', 'WLN: QV1', 'ACETIC ACID (MART.)', 'ACETIC ACID [MART.]', 'aceticacid', 'ACY', 'methane carboxylic acid', 'Essigsaure', 'Ethylate', 'acetic aicd', 'acetic-acid', 'Glacial acetate', 'acetic cid', 'actic acid', 'acetic -acid', 'Distilled vinegar', 'Methanecarboxylate', 'Acetic acid, glacial [USP:JAN]', 'Acetic acid,glacial', 'Carboxymethyl radical', 'Acetic acid, p.a.', 'Vinegar (Salt/Mix)', 'HOOCCH3', 'Acetic acid LC/MS Grade', 'ACETIC ACID [II]', 'ACETIC ACID [MI]', 'Acetic acid, ACS reagent', 'Otic Domeboro (Salt/Mix)', 'ACETIC ACID [FHFI]', 'Acetic Acid [for LC-MS]', 'ACETIC ACID [VANDF]', 'Acetic acid, glacial (USP)', 'ACETIC ACID [WHO-DD]', 'ACETIC ACID [WHO-IP]', 'ACETICUM ACIDUM [HPUS]', 'Acetic Acid Glacial HPLC Grade', 'Acetic acid, analytical standard', 'Acetic acid, Glacial USP grade', 'Acetic acid, Glacial, ACS Reagent', 'FA 2:0', 'ACIDUM ACETICUM [WHO-IP LATIN]', 'Acetic acid, purified by double-distillation', 'Bifido Selective Supplement B, for microbiology', 'ORLEX HC COMPONENT ACETIC ACID, GLACIAL', 'VOSOL HC COMPONENT ACETIC ACID, GLACIAL', 'TRIDESILON COMPONENT ACETIC ACID, GLACIAL', 'ACETASOL HC COMPONENT ACETIC ACID, GLACIAL', 'Glacial acetic acid, meets USP testing specifications', 'InChI=1/C2H4O2/c1-2(3)4/h1H3,(H,3,4', 'Glacial acetic acid, United States Pharmacopeia (USP) Reference Standard', 'Glacial Acetic Acid, Pharmaceutical Secondary Standard; Certified Reference Material'] |
177 | Acetaldehyde | C2H4O | acetaldehyde | InChI=1S/C2H4O/c1-2-3/h2H,1H3 | CC=O | ['acetaldehyde', 'ethanal', 'acetic aldehyde', 'ethyl aldehyde', 'Acetaldehyd', 'Acetylaldehyde', 'aldehyde', 'Aldeide acetica', 'Octowy aldehyd', 'Aldehyde acetique', 'Ethylaldehyde', 'Azetaldehyd', 'Acetic ethanol', 'acetaldehydes', 'Acetaldehyde (natural)', 'ACETYL GROUP', 'ethaldehyde', 'UNII-GO1N1ZPR3B', 'GO1N1ZPR3B', 'CH3CHO', 'ethanone', 'ACETALDEHYDE (IARC)', 'ACETALDEHYDE [IARC]', 'ACETALDEHYDE (USP-RS)', 'ACETALDEHYDE [USP-RS]', 'Acetaldehyd [German]', 'Acetaldehido', 'Octowy aldehyd [Polish]', 'Aldeide acetica [Italian]', 'Aldehyde acetique [French]', 'acetaldhyde', 'acetoaldehyde', 'Acetaldeyde', 'Acetehyde', 'acetic hydride', 'ethan-1-one', '8 - Formaldehyde', 'MeCHO', 'Acetaldehyde Phenolic', 'ACETALD', 'CH2CHO', 'ACETALDEHYDE [MI]', 'ACETALDEHYDE [FCC]', 'ACETALDEHYDE [FHFI]', 'ACETALDEHYDE [HPUS]', 'ACETALDEHYDE [HSDB]', 'WLN: VH1', 'ACETALDEHYDE [WHO-DD]', 'Acetaldehyde, analytical standard', 'InChI=1/C2H4O/c1-2-3/h2H,1H', 'Acetaldehyde, United States Pharmacopeia (USP) Reference Standard', 'VINYL ALCOHOL (FROM ALCOHOLYSIS OR HYDROLYSIS OF VINYL ACETATE UNITS)'] |
178 | Acetamide | C2H5NO | acetamide | InChI=1S/C2H5NO/c1-2(3)4/h1H3,(H2,3,4) | CC(=O)N | ['acetamide', 'Ethanamide', 'Acetic acid amide', 'Methanecarboxamide', 'Acetimidic acid', 'Ethanimidic acid', 'acetamid', 'Amide C2', 'Amid kyseliny octove', 'Acetimidic acid (VAN)', 'CCRIS 2', 'CH3CONH2', 'Amid kyseliny octove [Czech]', 'Essigsaeureamid', 'Ethanamid', 'ACETAMIDE [MI]', 'ACETAMIDE [FHFI]', 'ACETAMIDE [HSDB]', 'ACETAMIDE [IARC]', 'ACETAMIDE [WHO-DD]', 'ACETAMIDE (IARC)', 'acetoamide', 'acetamido', 'acetylamine', 'imidoacetic acid', 'N-Methylformamde', 'methanecarboxyamide', 'methane, carbamoyl-', 'Acetamido (Spanish)', 'WLN: ZV1', 'Acetic acid amide;Ethanamide', 'Acetamide, analytical standard', 'Amid kyseliny octove (Polish)', 'Acetamide (6CI,7CI,8CI,9CI)'] |
179 | Acetoin | C4H8O2 | 3-hydroxybutan-2-one | InChI=1S/C4H8O2/c1-3(5)4(2)6/h3,5H,1-2H3 | CC(C(=O)C)O | ['acetoin', '3-hydroxy-2-butanone', '3-hydroxybutan-2-one', 'Acetyl methyl carbinol', 'acetylmethylcarbinol', 'Dimethylketol', '2-Butanone, 3-hydroxy-', '2,3-Butanolone', '2-Hydroxy-3-butanone', '1-Hydroxyethyl methyl ketone', 'Acetoin (natural)', 'Methanol, acetylmethyl-', 'Acethoin', 'gamma-Hydroxy-beta-oxobutane', '3-hydroxyl-2-butanone', '2-Acetoin', '2-Butanol-3-one', 'Butan-2-ol-3-one', 'acetoine', '2-hydroxy-3-oxobutane', '(+/-)-Acetoin', 'beta-oxobutane', 'b-oxobutane', 'Acetoin dimer', '.gamma.-Hydroxy-.beta.-oxobutane', 'DL-Acetoin', '3-Oxo-2-butanol', 'ACETOIN MONOMER', 'DI-METHYLKETOL', 'Methanol, acetylmethyl', '(+/-)-3-Hydroxybutan-2-one', 'ACETOIN (DIMER)', 'ACETOIN [FHFI]', 'ACETOIN [HSDB]', 'ACETOIN [MI]', 'ACETOIN (MONOMER)', 'Butan-2-one, 3-hydroxy-', 'ACETOIN (DIMER) [FCC]', 'ACETOIN (MONOMER) [FCC]', '3H-2B butanone', '1-Hydroxethyl methyl ketone', 'acetylmethyl-', '2-Butanone, 3-hydroxy-, (R)-', 'Butan2ol3one', '2Hydroxy3butanone', '3Hydroxy2butanone', '2,3Butanolone', '2Butanone, 3hydroxy', 'g-Hydroxy-b-oxobutane', '3-hydroxy-2-oxobutane', 'gammaHydroxybetaoxobutane', '2-butanone, 3-hydroxy', '3-hydroxy-butan-2-one', '3-hydroxy-butane-2-one', '1Hydroxyethyl methyl ketone', 'Acetoin, analytical standard', '(+-)-ACETOIN', 'BUTAN-2-0L-3-ONE', '(.+-.)-ACETOIN', '2-Butanone, 3-hydroxy-, dimer', 'ACETOIN(MAY INCLUDE DIMER)', '(S)-3-HYDROXY-2-BUTANONE', '(+-)-3-HYDROXYBUTAN-2-ONE', '2-Butanone, 3-hydroxy- (8CI,9CI)', 'Acetoin, May exist as crystalline dimer', 'Acetoin (may exist as crystalline dimer)', '(.+-.)-3-HYDROXYBUTAN-2-ONE', '2-Butanone, 3-hydroxy-, (.+/-.)-', '3-Hydroxybutan-2-one (may include dimer)', '2,3,5,6- TETRAMETHYL-1,4-DIOXANE-2,5-DIOL'] |
180 | Acetone | C3H6O | propan-2-one | InChI=1S/C3H6O/c1-3(2)4/h1-2H3 | CC(=O)C | ['acetone', '2-propanone', 'propanone', 'propan-2-one', 'Dimethyl ketone', 'Pyroacetic ether', 'Methyl ketone', 'Dimethylformaldehyde', 'beta-Ketopropane', 'Dimethylketal', 'Chevron acetone', 'Ketone propane', 'Aceton', 'Pyroacetic acid', 'Ketone, dimethyl', 'dimethylketone', 'Acetone (natural)', 'Dimethyl formaldehyde', 'Taimax', 'dimethylcetone', 'Dimethylketon', 'Propanon', 'Azeton', 'Aceton [German, Dutch, Polish]', 'Ketone, dimethyl-', '.beta.-Ketopropane', 'Acetone [NF]', '(CH3)2CO', 'Acetone (NF)', 'ACETONE (MART.)', 'ACETONE [MART.]', 'ACETONE (EP IMPURITY)', 'ACETONE [EP IMPURITY]', 'ACETONE (EP MONOGRAPH)', 'ACETONE [EP MONOGRAPH]', 'Acetona', 'ISOFLURANE IMPURITY F (EP IMPURITY)', 'ISOFLURANE IMPURITY F [EP IMPURITY]', 'CHLOROBUTANOL IMPURITY B (EP IMPURITY)', 'CHLOROBUTANOL IMPURITY B [EP IMPURITY]', 'ACETONE (1,1,1,3,3,3-D6)', 'isopropanal', 'methylketone', 'Sasetone', 'methyl-ketone', '2propanone', 'b-Ketopropane', '2-propanal', 'Acetone ACS', 'Acetone (TN)', 'Acetone HPLC grade', 'methyl methyl ketone', 'Acetone, for HPLC', 'Acetone, ACS reagent', 'Acetone, HPLC Grade', 'TAK - Toxic Alcohols', 'ACETONE [VANDF]', 'ACETONE [FHFI]', 'ACETONE [HSDB]', 'Acetone ACS low benzene', 'ACETONE [FCC]', 'ACETONE [MI]', 'CH3COCH3', 'ACETONE [USP-RS]', 'ACETONE [WHO-DD]', 'Acetone, histological grade', 'Acetone, analytical standard', 'Acetone, Environmental Grade', 'Acetone, Semiconductor Grade', 'Aceton (GERMAN, POLISH)', 'WLN: 1V1', 'Acetone, Spectrophotometric Grade', 'DESFLURANE IMPURITY H [EP IMPURITY]', 'InChI=1/C3H6O/c1-3(2)4/h1-2H', 'Acetone, suitable for determination of dioxins', 'Acetone, glass distilled HRGC/HPLC trace grade', 'TAS - Toxic alcohols in Human serum (Quantitative)', 'Acetone, United States Pharmacopeia (USP) Reference Standard', 'Acetone, Pharmaceutical Secondary Standard; Certified Reference Material'] |
181 | Acetyl coenzyme A sodium salt | C23H38N7O17P3S | S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] ethanethioate | InChI=1S/C23H38N7O17P3S/c1-12(31)51-7-6-25-14(32)4-5-26-21(35)18(34)23(2,3)9-44-50(41,42)47-49(39,40)43-8-13-17(46-48(36,37)38)16(33)22(45-13)30-11-29-15-19(24)27-10-28-20(15)30/h10-11,13,16-18,22,33-34H,4-9H2,1-3H3,(H,25,32)(H,26,35)(H,39,40)(H,41,42)(H2,24,27,28)(H2,36,37,38) | CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O | ['Acetyl coenzyme A sodium salt', 'Acetyl-CoenzymeA'] |
182 | [3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] [hydroxy(3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaenoxy)phosphoryl] hydrogen phosphate | C63H105NO12P2 | [3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] [hydroxy(3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaenoxy)phosphoryl] hydrogen phosphate | InChI=1S/C63H105NO12P2/c1-47(2)24-14-25-48(3)26-15-27-49(4)28-16-29-50(5)30-17-31-51(6)32-18-33-52(7)34-19-35-53(8)36-20-37-54(9)38-21-39-55(10)40-22-41-56(11)42-23-43-57(12)44-45-73-77(69,70)76-78(71,72)75-63-60(64-58(13)66)62(68)61(67)59(46-65)74-63/h24,26,28,30,32,34,36,38,40,42,44,59-63,65,67-68H,14-23,25,27,29,31,33,35,37,39,41,43,45-46H2,1-13H3,(H,64,66)(H,69,70)(H,71,72) | CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCOP(=O)(O)OP(=O)(O)OC1C(C(C(C(O1)CO)O)O)NC(=O)C)C)C)C)C)C)C)C)C)C)C)C | [] |
183 | [3-Acetamido-5-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl] [hydroxy(3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaenoxy)phosphoryl] hydrogen phosphate | C71H118N2O17P2 | [3-acetamido-5-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl] [hydroxy(3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaenoxy)phosphoryl] hydrogen phosphate | InChI=1S/C71H118N2O17P2/c1-49(2)25-15-26-50(3)27-16-28-51(4)29-17-30-52(5)31-18-32-53(6)33-19-34-54(7)35-20-36-55(8)37-21-38-56(9)39-22-40-57(10)41-23-42-58(11)43-24-44-59(12)45-46-85-91(81,82)90-92(83,84)89-71-65(73-61(14)77)68(80)69(63(48-75)87-71)88-70-64(72-60(13)76)67(79)66(78)62(47-74)86-70/h25,27,29,31,33,35,37,39,41,43,45,62-71,74-75,78-80H,15-24,26,28,30,32,34,36,38,40,42,44,46-48H2,1-14H3,(H,72,76)(H,73,77)(H,81,82)(H,83,84) | CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCOP(=O)(O)OP(=O)(O)OC1C(C(C(C(O1)CO)OC2C(C(C(C(O2)CO)O)O)NC(=O)C)O)NC(=O)C)C)C)C)C)C)C)C)C)C)C)C | [] |
184 | 4-[[3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]-2-amino-4-oxobutanoic acid | C12H21N3O8 | 4-[[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]-2-amino-4-oxobutanoic acid | InChI=1S/C12H21N3O8/c1-4(17)14-8-10(20)9(19)6(3-16)23-11(8)15-7(18)2-5(13)12(21)22/h5-6,8-11,16,19-20H,2-3,13H2,1H3,(H,14,17)(H,15,18)(H,21,22) | CC(=O)NC1C(C(C(OC1NC(=O)CC(C(=O)O)N)CO)O)O | ['4-[[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]-2-amino-4-oxobutanoic acid', 'AADG;Aspartylglucosamine;N-gamma-(2-Acetamido-2-deoxy-beta-D-gluco-pyranosyl)-L-asparagine', 'N-Asn', '2-acetamido-n-beta-aspartyl-2-deoxyhexopyranosylamine'] |
185 | N-Acetyl-DL-glutamic acid | C7H11NO5 | 2-acetamidopentanedioic acid | InChI=1S/C7H11NO5/c1-4(9)8-5(7(12)13)2-3-6(10)11/h5H,2-3H2,1H3,(H,8,9)(H,10,11)(H,12,13) | CC(=O)NC(CCC(=O)O)C(=O)O | ['2-acetamidopentanedioic acid', 'N-Acetyl-DL-glutamic acid', 'N-acetylglutamic acid', 'ACEGLUMATE', 'DL-Acetylglutamic acid', 'Acetyl-DL-glutamic acid', 'acetylglutamate', 'Glutamic acid, N-acetyl-', 'N-Acetyl-DL-glutamicAcid', 'acetyl-glu', '2-acetamidopentanedioicacid', 'DL-Glutamic acid, N-acetyl-', 'RFMMMVDNIPUKGG-UHFFFAOYSA-N', 'N-Acetylglutamic acid (Ac-DL-Glu-OH)'] |
186 | Acetyl phosphate | C2H5O5P | phosphono acetate | InChI=1S/C2H5O5P/c1-2(3)7-8(4,5)6/h1H3,(H2,4,5,6) | CC(=O)OP(=O)(O)O | ['acetylphosphate', 'acetyl phosphate', 'phosphono acetate', 'acetyl dihydrogen phosphate', '(acetyloxy)phosphonic acid', 'acetyl-P', 'Acetic acid, monoanhydride with phosphoric acid', 'acetic phosphoric monoanhydride', 'Acetylphosphic acid', 'UVW', 'acetylphosphoric acid', 'acetic-phosphoricanhydride', 'acetylphosphat', 'monoacetyl phosphate', 'Acetyl phosphoric acid', 'Monoacetyl phosphoric acid', 'LIPOUNRJVLNBCD-UHFFFAOYSA-N', 'Acetate, monoanhydride with phosphate', 'Acetyl phosphate (C2H3O2(HO)2PO)', 'ethanol, 1-oxo-, dihydrogen phosphate', 'Acetic acid, anhydride with H3PO4 (6CI)', 'Phosphoric acid, anhydride with AcOH (6CI)', 'Phosphoric acid, monoanhydride with acetic acid (8CI)', 'Acetic acid, monoanhydride with phosphoric acid (8CI,9CI)'] |
187 | Acetylcholine | C7H16NO2+ | 2-acetyloxyethyl(trimethyl)azanium | InChI=1S/C7H16NO2/c1-7(9)10-6-5-8(2,3)4/h5-6H2,1-4H3/q+1 | CC(=O)OCC[N+](C)(C)C | ['acetylcholine', 'Choline acetate', 'O-Acetylcholine', '(2-Acetoxyethyl)trimethylammonium', 'Acetyl choline ion', 'Acetylcholinum', 'Choline acetate (ester)', 'Acetyl choline cation', '2-(Acetyloxy)-N,N,N-trimethylethanaminium', 'Ach', 'Azetylcholin', '2-acetyloxyethyl(trimethyl)azanium', 'ethanaminium, 2-(acetyloxy)-N,N,N-trimethyl-', 'Acetylcholine cation', '(2-Acetoxyethyl)trimetilammonium', '[2-(acetyloxy)ethyl]trimethylazanium', '2-acetyloxy-N,N,N-trimethylethanaminium', '2-acetyloxyethyl-trimethylazanium', 'ACETYLCHOLINE (USP IMPURITY)', 'ACETYLCHOLINE [USP IMPURITY]', '[3H]acetylcholine', '2rin', '3rqw', '2ha4', '2xz5', 'ACETYLCHOLINE [VANDF]', 'ACETYLCHOLINE [WHO-DD]', 'Acetylcholinium: acetyl-Choline', '2-acetoxyethyl(trimethyl)ammonium;bromide', '2-Acetoxy-N,N,N-trimethylethan-1-aminium', 'ethanaminium, 2-(acetyloxy)-N,N,N-trimethyl', 'Ethanaminium, 2-(acetyloxy)-N,N,N-trimethyl- (9CI)'] |
188 | Hex(?1-4)Hex1Ac | C14H24O12 | [3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl] acetate | InChI=1S/C14H24O12/c1-4(17)23-13-11(22)9(20)12(6(3-16)25-13)26-14-10(21)8(19)7(18)5(2-15)24-14/h5-16,18-22H,2-3H2,1H3 | CC(=O)OC1C(C(C(C(O1)CO)OC2C(C(C(C(O2)CO)O)O)O)O)O | [] |
189 | 3-Acetyloxy-2-aminopropanoic acid | C5H9NO4 | 3-acetyloxy-2-aminopropanoic acid | InChI=1S/C5H9NO4/c1-3(7)10-2-4(6)5(8)9/h4H,2,6H2,1H3,(H,8,9) | CC(=O)OCC(C(=O)O)N | ['O-Acetyl-DL-serine', '3-acetyloxy-2-aminopropanoic acid', '3-(acetyloxy)-2-aminopropanoic acid', 'Serine acetate ester', 'o-Acetylserine #', 'O-acetyl-d,l-serine', 'Serine, acetate (ester)', 'DL-Serine, acetate (ester)', 'VZXPDPZARILFQX-UHFFFAOYSA-N'] |
190 | Adenine | C5H5N5 | 7H-purin-6-amine | InChI=1S/C5H5N5/c6-4-3-5(9-1-7-3)10-2-8-4/h1-2H,(H3,6,7,8,9,10) | C1=NC2=NC=NC(=C2N1)N | ['adenine', '6-Aminopurine', '1H-Purin-6-amine', '9H-Purin-6-amine', '7H-Purin-6-amine', 'Vitamin B4', 'Adenin', 'Adeninimine', 'Leuco-4', '6-Amino-1H-purine', '6-Amino-3H-purine', '6-Amino-7H-purine', '6-Amino-9H-purine', '1,6-Dihydro-6-iminopurine', 'Purine, 6-amino-', '3,6-Dihydro-6-iminopurine', '1H-Purine, 6-amino', 'Adenine [JAN]', 'ADE', '9H-Purine, 1,6-dihydro-6-imino-', '3H-Purin-6(7H)-imine', '1H-Purine-6-amine', '7H-Purin-6-amine (9CI)', '9H-Purine-6-amine', '9H-purin-6-ylamine', 'Adenine [USP:JAN]', '1H-Purine, 6-amino-', '6H-Purin-6-imine, 3,9-dihydro-, (Z)- (9CI)', '6,7-dihydro-3H-purin-6-imine', '6H-Purin-6-imine, 1,7-dihydro-, (Z)- (9CI)', '6H-Purin-6-imine, 1,9-dihydro-, (E)- (9CI)', '6H-Purin-6-imine, 3,7-dihydro-, (Z)- (9CI)', '(Z)-3,9-Dihydro-6H-purin-6-imine', 'Adenine (USP:JAN)', 'Pedatisectine B', 'ADENINE (MART.)', 'ADENINE [MART.]', 'ADENINE (USP-RS)', 'ADENINE [USP-RS]', 'Adenine; 7H-purin-6-amine', 'Vitamin B 4', 'ADENINE (EP MONOGRAPH)', 'ADENINE (USP IMPURITY)', 'ADENINE [EP MONOGRAPH]', 'ADENINE [USP IMPURITY]', '4, Vitamin B', 'B 4, Vitamin', 'ADENINE (USP MONOGRAPH)', 'ADENINE [USP MONOGRAPH]', 'Adenine, United States Pharmacopeia (USP) Reference Standard', 'adenine-ring', 'Adenine (8CI)', 'Adenine (JAN/USP)', '1H-purin-6(9H)-imine', '1H-Purin-6-amine (9CI)', '3H-Purin-6-amine (9CI)', '6-Purinylamine', '3h-adenine', '6-amino purine', '6-amino-Purine', 'purin-6-amine', '1jys', '1nli', '1wei', '2pqj', '3kpv', '[3H]adenine', 'Adenine, 1', 'Adenine,(S)', 'Adenine (Standard)', '7H-purin-6-ylamine', '(S)-Norfluoxetine-d5', '9H-Purin-6-yl-amin', '2p8n', '9H-Purin-6-yl-amine', 'ADENINE [VANDF]', '9H-Purin-6-amine #', 'ADENINE [MI]', 'ADENINE [WHO-DD]', '6-Aminopurine;Vitamin B4', 'Adenine, cell culture grade', '9H-Purine,6-dihydro-6-imino-', 'ADENOSINE IMPURITY A [EP IMPURITY]', 'Adenine, suitable for cell culture, BioReagent', 'Adenine, European Pharmacopoeia (EP) Reference Standard', 'Adenine, Pharmaceutical Secondary Standard; Certified Reference Material'] |
191 | 2-(6-Aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol | C10H13N5O4 | 2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol | InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13) | C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N | ['2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol', '.beta.-Adenosine', '9-Arabinosyladenine', '2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol', 'Xylosyladenine', '9-Xylosyladenine', 'Xylosyl A', '.beta.-D-Arabinosyladenine', 'Vidarabin', '9.beta.-D-Arabinofuranosyladenine', 'Adenine .beta.-d-arabinofuranoside', 'Adenine 9-beta-D-arabinofuranoside', '9-pentofuranosyl-9H-purin-6-amine', 'Vira ATM', '.beta.-D-Adenosine', 'Adenine, 9-.alpha.-D-xylofuranosyl-', 'Adenine, 9.beta.-D-arabinofuranosyl-', '9-alpha-L-Ribofuranosyl-9H-purin-6-amine', '9-alpha-Ribofuranosyladenine', '9H-Purin-6-amine, 9-.alpha.-D-xylofuranosyl-', '9H-Purin-6-amine, 9.beta.-D-arabinofuranosyl-', '9-.alpha.-D-Xylofuranosyladenine', '.beta.-D-Ribofuranoside, adenine-9', '9-.alpha.-D-Arabinofuranosyladenine', 'VIRDARABINE', '6-Amino-9.beta.-D-ribofuranosyl-9H-purine', '9-.beta.-D-Arabinofuranosyl-9H-purin-6-amine', 'Adenine, 9-.alpha.-D-arabinofuranosyl-', '9H-Purin-6-amine, 9-b-D-lyxofuranosyl-', '9-.beta.-Arabinoadenosine', '9-.beta.-Arabinosyladenine', '.beta.-D-Ribofuranose, 1-(6-amino-9H-purin-9-yl)-1-deoxy-', '9H-Purin-6-amine, 9-.alpha.-D-arabinofuranosyl-', '9.beta.-D-Ribofuranosyladenine', '9-.beta.-D-Xylofuranosyladenine', '.alpha.-D-Arabinofuranosyladenine', '(2R,3R,4R,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol', '(2S,3S,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol', 'OIRDTQYFTABQOQ-UHFFFAOYSA-N', 'Adenine-.beta.-D-arabinofuranoside', '9-.beta.-D-Arabinofuranosyladenine', 'Adenine, 9-.beta.-D-xylofuranosyl-', 'Adenine-9-.beta.-D-arabinofuranoside', 'Adenine, 9-.beta.-D-arabinofuranosyl-', '6-Amino-9-.beta.-D-arabinofuranosylpurine', '9H-Purin-6-amine, 9.beta.-D-ribofuranosyl-', 'Beta-L-adenosine pound>>(c)micro-L-Adenosine', '9H-Purin-6-amine, 9-.beta.-D-xylofuranosyl-', 'alpha-Adenosine;9-?(c) paragraph sign-?D-?ribofuranosyl-9H-?Purin-?6-?amine'] |
192 | Adenosine diphosphate ribose | C15H23N5O14P2 | [[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] (3,4,5-trihydroxyoxolan-2-yl)methyl hydrogen phosphate | InChI=1S/C15H23N5O14P2/c16-12-7-13(18-3-17-12)20(4-19-7)14-10(23)8(21)5(32-14)1-30-35(26,27)34-36(28,29)31-2-6-9(22)11(24)15(25)33-6/h3-6,8-11,14-15,21-25H,1-2H2,(H,26,27)(H,28,29)(H2,16,17,18) | C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)O)O)O)O)O)N | ['adenosine diphosphate ribose', 'adpribose', 'ADP-ribose', '[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [hydroxy-[(3,4,5-trihydroxyoxolan-2-yl)methox', "Adenosine 5'-diphosphoribose", "5'-Diphosphoribose, Adenosine", "5-(Adenosine 5'-pyrophosphoryl)-D-ribose", 'D-ribofuranos-5-yl-ADP', 'Ribose adenosine diphosphate'] |
193 | S-adenosyl-dl-homocysteine | C14H20N6O5S | 2-amino-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylsulfanyl]butanoic acid | InChI=1S/C14H20N6O5S/c15-6(14(23)24)1-2-26-3-7-9(21)10(22)13(25-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18) | C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CSCCC(C(=O)O)N)O)O)N | ['S-adenosyl-dl-homocysteine', "S-(5''-Adenosyl)-D-homocysteine", 'SAH (S-Adenosylhomocysteine)', 's-adenosyl-l-homocystein', '2-amino-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylsulanyl]butanoic acid', '2-amino-4-({[5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl}sulfanyl)butanoic acid', 'S-(((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)homocysteine', "SAH;S-(5'-adenosyl)-L-homocysteine;S-adenosylhomocysteine;5'-Deoxy-S-Adenosyl-L-Homocystmine"] |
194 | Bis(5'-adenylyl) diphosphate | C20H28N10O19P4 | [[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] hydrogen phosphate | InChI=1S/C20H28N10O19P4/c21-15-9-17(25-3-23-15)29(5-27-9)19-13(33)11(31)7(45-19)1-43-50(35,36)47-52(39,40)49-53(41,42)48-51(37,38)44-2-8-12(32)14(34)20(46-8)30-6-28-10-16(22)24-4-26-18(10)30/h3-8,11-14,19-20,31-34H,1-2H2,(H,35,36)(H,37,38)(H,39,40)(H,41,42)(H2,21,23,25)(H2,22,24,26) | C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)N | ["bis(5'-adenylyl) diphosphate", "adenosine(5')tetraphospho(5')adenosine", 'Ap4A', "A(5')p4(5')A"] |
195 | Aspartyl adenylate | C14H18N5O11P | 2-[[9-[3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]purin-6-yl]amino]butanedioic acid | InChI=1S/C14H18N5O11P/c20-7(21)1-5(14(24)25)18-11-8-12(16-3-15-11)19(4-17-8)13-10(23)9(22)6(30-13)2-29-31(26,27)28/h3-6,9-10,13,22-23H,1-2H2,(H,20,21)(H,24,25)(H,15,16,18)(H2,26,27,28) | C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O)NC(CC(=O)O)C(=O)O | ['Aspartyl adenylate', 'Adenylosuccinate;Aspartyl adenylate', '2-[[9-[3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]purin-6-yl]amino]butanedioic acid', 'adenylosuccinate'] |
196 | Adipic Acid | C6H10O4 | hexanedioic acid | InChI=1S/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10) | C(CCC(=O)O)CC(=O)O | ['adipic acid', 'hexanedioic acid', 'Adipinic acid', '1,4-Butanedicarboxylic acid', 'Acifloctin', 'Acinetten', 'Adilactetten', '1,6-Hexanedioic acid', 'Molten adipic acid', 'Kyselina adipova', 'Adipinsaeure', 'Adipinsaure', 'adipic-acid', 'Adipinsaure [German]', 'Acide adipique', 'Adipidic acid', 'Acide adipique [French]', 'Kyselina adipova [Czech]', 'Hexanedioate', 'ADIPIC-DB ACID', 'Hexanedioc acid', 'Adi-pure', 'Adipic acid [NF]', 'Hexan-1,6-dicarboxylate', '1,6-HEXANE-DIOIC ACID', 'Adipic acid (NF)', 'hexane-1,6-dioic acid', 'ADIPIC ACID (II)', 'ADIPIC ACID [II]', 'ADIPIC ACID (MART.)', 'ADIPIC ACID [MART.]', 'Adipic acid; Hexanedioic acid', 'adipicacid', 'ADIPIC ACID (EP MONOGRAPH)', 'ADIPIC ACID [EP MONOGRAPH]', 'Adipinate', 'Adilac-tetten', 'Molten adipate', 'hexane dioic acid', '1,6-Hexanedioate', '0L1', 'ASAPIC', 'INIPOL DS', 'Adipic acid (Standard)', 'ADIPIC ACID [MI]', 'WLN: QV4VQ', 'ADIPIC ACID [FCC]', 'ADIPIC ACID [FHFI]', 'ADIPIC ACID [HSDB]', 'HOOC-(CH2)4-COOH', 'ADIPIC ACID [USP-RS]', 'ADIPIC ACID [WHO-DD]', 'Adipic acid, certified reference material, TraceCERT(R)', 'Adipic acid, European Pharmacopoeia (EP) Reference Standard', 'Adipic acid, United States Pharmacopeia (USP) Reference Standard'] |
197 | [5-(6-Aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate | C10H15N5O10P2 | [5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate | InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20) | C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)O)O)O)N | ['Adenosine_Diphosphate', 'Adenosine disphosphate', 'Adenosine diphosphate;ADP', "Aenosine 5''-Diphosphate", '9-{5-o-[hydroxy(phosphonooxy)phosphoryl]pentofuranosyl}-9h-purin-6-amine', "5''-Adenosinediphosphate (5''-ADP)", '[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate', 'Trisodium adenosinediphosphate trihydrate', "Adenosine trisodium 5'-diphosphate trihydrate", 'diPhosphoric acid [5-(6-amino-purin-9-yl)-3,4-dihydroxy-tetrahydro-furan-2-ylmethyl] ester', '(ADP)[5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl trihydrogen diphosphate', '[(2S,3R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate', 'Diphosphoric acid -[5-(6-amino-purin-9-yl)-3,4-dihydroxy-tetrahydro-furan-2-ylmethyl] ester'] |
198 | [[5-(6-Aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate | C16H25N5O15P2 | [[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate | InChI=1S/C16H25N5O15P2/c17-13-7-14(19-3-18-13)21(4-20-7)15-11(26)9(24)6(33-15)2-32-37(28,29)36-38(30,31)35-16-12(27)10(25)8(23)5(1-22)34-16/h3-6,8-12,15-16,22-27H,1-2H2,(H,28,29)(H,30,31)(H2,17,18,19) | C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OC4C(C(C(C(O4)CO)O)O)O)O)O)N | [] |
199 | Agmatine | C5H14N4 | 2-(4-aminobutyl)guanidine | InChI=1S/C5H14N4/c6-3-1-2-4-9-5(7)8/h1-4,6H2,(H4,7,8,9) | C(CCN=C(N)N)CN | ['agmatine', '1-(4-Aminobutyl)guanidine', '(4-Aminobutyl)guanidine', 'Argmatine', '1-Amino-4-guanidobutane', 'N-(4-aminobutyl)guanidine', 'N-4-Aminobutylguanidine', 'guanidine, (4-aminobutyl)-', '2-(4-aminobutyl)guanidine', '(4-Aminobutyl) guanidine', '1,4-Butanediamine, N-(aminoiminomethyl)-', 'agmatinium', '4-Guanidino-1-butanamine', '1-Amino-4-guanidinobutane', 'AGMATINE SULFATE ENDOGENOUS AGONIST AT', 'AGMATINE [MI]', '(4-aminobutyl)-Guanidine', 'AGMATINE [WHO-DD]', 'N-(aminoiminomethyl)-1,4-Butanediamine', 'AG2', 'Guanidine, (4-aminobutyl)- (8CI)(9CI)', '1 Amino 4 guanidinobutane', '.Agmatin', '1, N-(aminoiminomethyl)-', 'Guanidine, (4-aminobutyl)-(8CI)', 'Guanidine, (4-aminobutyl)-(8CI)(9CI)'] |
200 | 1H-imidazole-4-carboxamide, 5-amino-1-(5-O-phosphono-beta-D-ribofuranosyl)- | C9H15N4O8P | [5-(5-amino-4-carbamoylimidazol-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate | InChI=1S/C9H15N4O8P/c10-7-4(8(11)16)12-2-13(7)9-6(15)5(14)3(21-9)1-20-22(17,18)19/h2-3,5-6,9,14-15H,1,10H2,(H2,11,16)(H2,17,18,19) | C1=NC(=C(N1C2C(C(C(O2)COP(=O)(O)O)O)O)N)C(=O)N | ['ButylammoniumLeadIodide', '1H-imidazole-4-carboxamide, 5-amino-1-(5-O-phosphono-beta-D-ribofuranosyl)-', '[5-(5-amino-4-carbamoylimidazol-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate', "Imidazole-4-carboxamide, 5'-(dihydrogen phosphate)", '1H-Imidazole-4-carboxamide, 5-amino-1-(5-O-phosphono-.beta.-D-ribofuranosyl)-', 'Butylammonium Lead Iodide', '5-Amino-1-(5-O-phosphonopentofuranosyl)-1H-imidazole-4-carboxamide', '[5-(5-amino-4-carbamoyl-1-imidazolyl)-3,4-dihydroxy-2-oxolanyl]methyl dihydrogen phosphate'] |
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