 | | ABB | | Name: | (2S,4R)-1-ACETYL-N-[(1S)-4-[(AMINOIMINOMETHYL)AMINO]-1-(2-BENZOTHIAZOLYLCARBONYL)BUTYL]-4-HYDROXY-2-PYRROLIDINECARBOXAMIDE | | Formula: | C20 H26 N6 O4 S | | SMILES: | O=C(N1CC(O)CC1C(=O)NC(C(=O)c2nc3ccccc3s2)CCCNC(=[N@H])N)C | | InChi: | InChI=1S/C20H26N6O4S/c1-11(27)26-10-12(28)9-15(26)18(30)24-14(6-4-8-23-20(21)22)17(29)19-25-13-5-2-3-7-16(13)31-19/h2-3,5,7,12,14-15,28H,4,6,8-10H2,1H3,(H,24,30)(H4,21,22,23)/t12-,14+,15+/m1/s1 | | Definition date: | 2002-12-17 | | Last modified: | 2024-09-27 | | Identifier: | (4R)-1-acetyl-N-[(1S)-1-(1,3-benzothiazol-2-ylcarbonyl)-4-carbamimidamidobutyl]-4-hydroxy-L-prolinamide |
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 | | ABN | | Name: | BENZYLAMINE | | Formula: | C7 H9 N | | SMILES: | NCc1ccccc1 | | InChi: | InChI=1S/C7H9N/c8-6-7-4-2-1-3-5-7/h1-5H,6,8H2 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | 1-phenylmethanamine |
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 | | ABU | | Name: | GAMMA-AMINO-BUTANOIC ACID | | Formula: | C4 H9 N O2 | | SMILES: | O=C(O)CCCN | | InChi: | InChI=1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7) | | Synonyms: | GAMMA(AMINO)-BUTYRIC ACID | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | 4-aminobutanoic acid |
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 | | ABZ | | Name: | 4-[4-AMINO-6-(5-CHLORO-1H-INDOL-4-YLMETHYL)-[1,3,5]TRIAZIN-2-YLAMINO]-BENZONITRILE | | Formula: | C19 H14 Cl N7 | | SMILES: | N#Cc1ccc(cc1)Nc2nc(nc(n2)Cc3c(Cl)ccc4c3ccn4)N | | InChi: | InChI=1S/C19H14ClN7/c20-15-5-6-16-13(7-8-23-16)14(15)9-17-25-18(22)27-19(26-17)24-12-3-1-11(10-21)2-4-12/h1-8,23H,9H2,(H3,22,24,25,26,27) | | Definition date: | 2001-12-07 | | Last modified: | 2024-09-27 | | Identifier: | 4-({4-amino-6-[(5-chloro-1H-indol-4-yl)methyl]-1,3,5-triazin-2-yl}amino)benzonitrile |
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 | | AC0 | | Name: | 1-PHENYLETHANONE | | Formula: | C8 H8 O | | SMILES: | O=C(c1ccccc1)C | | InChi: | InChI=1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3 | | Synonyms: | ACETOPHENONE | | Definition date: | 2005-05-10 | | Last modified: | 2024-09-27 | | Identifier: | 1-phenylethanone |
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 | | AC5 | | Name: | 1-AMINOCYCLOPENTANECARBOXYLIC ACID | | Formula: | C6 H11 N O2 | | SMILES: | O=C(O)C1(N)CCCC1 | | InChi: | InChI=1S/C6H11NO2/c7-6(5(8)9)3-1-2-4-6/h1-4,7H2,(H,8,9) | | Synonyms: | CYCLO-LEUCINE | | Definition date: | 2004-11-22 | | Last modified: | 2024-09-27 | | Identifier: | 1-aminocyclopentanecarboxylic acid |
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 | | ACA | | Name: | 6-AMINOHEXANOIC ACID | | Formula: | C6 H13 N O2 | | SMILES: | O=C(O)CCCCCN | | InChi: | InChI=1S/C6H13NO2/c7-5-3-1-2-4-6(8)9/h1-5,7H2,(H,8,9) | | Synonyms: | AMINOCAPROIC ACID | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | 6-aminohexanoic acid |
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 | | ACB | | Name: | 3-METHYL-BETA-D-ASPARTIC ACID | | Formula: | C5 H9 N O4 | | SMILES: | O=C(O)C(N)C(C(=O)O)C | | InChi: | InChI=1S/C5H9NO4/c1-2(4(7)8)3(6)5(9)10/h2-3H,6H2,1H3,(H,7,8)(H,9,10)/t2-,3+/m0/s1 | | Synonyms: | (3S)-3-methyl-D-aspartic acid | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | (3S)-3-methyl-D-aspartic acid |
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 | | ACD | | Name: | ARACHIDONIC ACID | | Formula: | C20 H32 O2 | | SMILES: | O=C(O)CCCC=C/CC=C/CC=C/CC=C/CCCCC | | InChi: | InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-15- | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid |
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 | | ACE | | Name: | ACETYL GROUP | | Formula: | C2 H4 O | | SMILES: | O=CC | | InChi: | InChI=1S/C2H4O/c1-2-3/h2H,1H3 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | acetaldehyde |
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 | | ACF | | Name: | 3-{[(2R,5S)-5-{[(2S)-2-(AMINOMETHYL)PYRROLIDIN-1-YL]CARBONYL}PYRROLIDIN-2-YL]METHOXY}-4-CHLOROBENZOIC ACID | | Formula: | C18 H24 Cl N3 O4 | | SMILES: | O=C(O)c3cc(OCC2NC(C(=O)N1C(CN)CCC1)CC2)c(Cl)cc3 | | InChi: | InChI=1S/C18H24ClN3O4/c19-14-5-3-11(18(24)25)8-16(14)26-10-12-4-6-15(21-12)17(23)22-7-1-2-13(22)9-20/h3,5,8,12-13,15,21H,1-2,4,6-7,9-10,20H2,(H,24,25)/t12-,13+,15+/m1/s1 | | Definition date: | 2006-03-09 | | Last modified: | 2024-09-27 | | Identifier: | 3-{[(2R,5S)-5-{[(2S)-2-(aminomethyl)pyrrolidin-1-yl]carbonyl}pyrrolidin-2-yl]methoxy}-4-chlorobenzoic acid |
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 | | ACH | | Name: | ACETYLCHOLINE | | Formula: | C7 H16 N O2 | | SMILES: | O=C(OCC[N+](C)(C)C)C | | InChi: | InChI=1S/C7H16NO2/c1-7(9)10-6-5-8(2,3)4/h5-6H2,1-4H3/q+1 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | 2-(acetyloxy)-N,N,N-trimethylethanaminium |
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 | | ACM | | Name: | ACETAMIDE | | Formula: | C2 H5 N O | | SMILES: | O=C(N)C | | InChi: | InChI=1S/C2H5NO/c1-2(3)4/h1H3,(H2,3,4) | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | acetamide |
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 | | ACN | | Name: | ACETONE | | Formula: | C3 H6 O | | SMILES: | O=C(C)C | | InChi: | InChI=1S/C3H6O/c1-3(2)4/h1-2H3 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | propan-2-one |
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 | | ACO | | Name: | ACETYL COENZYME *A | | Formula: | C23 H38 N7 O17 P3 S | | SMILES: | O=C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC3OC(n2cnc1c(ncnc12)N)C(O)C3OP(=O)(O)O)C | | InChi: | 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)/t13-,16-,17-,18+,22-/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | S-{(9R,13S,15S)-17-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-9,13,15-trihydroxy-10,10-dimethyl-13,15-dioxido-4,8-dioxo-12,14,16-trioxa-3,7-diaza-13,15-diphosphaheptadec-1-yl} ethanethioate (non-preferred name) |
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 | | ACT | | Name: | ACETATE ION | | Formula: | C2 H3 O2 | | SMILES: | [O-]C(=O)C | | InChi: | InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | acetate |
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 | | ACY | | Name: | ACETIC ACID | | Formula: | C2 H4 O2 | | SMILES: | O=C(O)C | | InChi: | InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4) | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | acetic acid |
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 | | ADF | | Name: | 4-{[(2R,5S)-5-{[(2S)-2-(AMINOMETHYL)PYRROLIDIN-1-YL]CARBONYL}PYRROLIDIN-2-YL]METHOXY}-3-TERT-BUTYLBENZOIC ACID | | Formula: | C22 H33 N3 O4 | | SMILES: | O=C(O)c3ccc(OCC2NC(C(=O)N1C(CN)CCC1)CC2)c(c3)C(C)(C)C | | InChi: | InChI=1S/C22H33N3O4/c1-22(2,3)17-11-14(21(27)28)6-9-19(17)29-13-15-7-8-18(24-15)20(26)25-10-4-5-16(25)12-23/h6,9,11,15-16,18,24H,4-5,7-8,10,12-13,23H2,1-3H3,(H,27,28)/t15-,16+,18+/m1/s1 | | Definition date: | 2006-03-08 | | Last modified: | 2024-09-27 | | Identifier: | 4-{[(2R,5S)-5-{[(2S)-2-(aminomethyl)pyrrolidin-1-yl]carbonyl}pyrrolidin-2-yl]methoxy}-3-tert-butylbenzoic acid |
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 | | ADM | | Name: | ADAMANTANE | | Formula: | C10 H16 | | SMILES: | C1C2CC3CC1CC(C2)C3 | | InChi: | InChI=1S/C10H16/c1-7-2-9-4-8(1)5-10(3-7)6-9/h7-10H,1-6H2/t7-,8+,9-,10+ | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | tricyclo[3.3.1.1~3,7~]decane |
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 | | ADT | | Name: | 3'-DEOXY-3'-ACETAMIDO-THYMIDINE | | Formula: | C12 H17 N3 O5 | | SMILES: | O=C1NC(=O)N(C=C1C)C2OC(C(NC(=O)C)C2)CO | | InChi: | InChI=1S/C12H17N3O5/c1-6-4-15(12(19)14-11(6)18)10-3-8(13-7(2)17)9(5-16)20-10/h4,8-10,16H,3,5H2,1-2H3,(H,13,17)(H,14,18,19)/t8-,9+,10+/m0/s1 | | Synonyms: | ((((3'-DEOXY-3'-THYMIDINYL)-AMINO)CARBONYL)METHYL) | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | 3'-(acetylamino)-3'-deoxythymidine |
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 | | AEA | | Name: | (2-AMINO-2-CARBAMOYL-ETHYLSULFANYL)-ACETIC ACID | | Formula: | C5 H10 N2 O3 S | | SMILES: | NC(CSCC(=O)O)C(N)=O | | InChi: | InChI=1S/C5H10N2O3S/c6-3(5(7)10)1-11-2-4(8)9/h3H,1-2,6H2,(H2,7,10)(H,8,9)/t3-/m1/s1 | | Definition date: | 1999-08-25 | | Last modified: | 2024-09-27 | | Identifier: | {[(2S)-2,3-diamino-3-oxopropyl]sulfanyl}acetic acid |
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 | | AEI | | Name: | THREONINE-ASPARTIC ESTER | | Formula: | C8 H14 N2 O6 | | SMILES: | NC(C(=O)O)C(C)OC(=O)CC(N)C(=O)O | | InChi: | InChI=1S/C8H14N2O6/c1-3(6(10)8(14)15)16-5(11)2-4(9)7(12)13/h3-4,6H,2,9-10H2,1H3,(H,12,13)(H,14,15)/t3-,4+,6+/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | (2S)-2-amino-4-{[(1S,2R)-1-amino-1-carboxypropan-2-yl]oxy}-4-oxobutanoic acid (non-preferred name) |
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 | | AEM | | Name: | 2-AMINOETHANIMIDIC ACID | | Formula: | C2 H6 N2 | | SMILES: | [N@H]=CCN | | InChi: | InChI=1S/C2H6N2/c3-1-2-4/h1,3H,2,4H2/b3-1+ | | Definition date: | 2001-09-25 | | Last modified: | 2024-09-27 | | Identifier: | (2E)-2-iminoethanamine |
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 | | AEN | | Name: | 5-(1-SULFONAPHTHYL)-ACETYLAMINO-ETHYLAMINE | | Formula: | C14 H16 N2 O4 S | | SMILES: | O=S(=O)(O)c1cccc2c1cccc2NCCNC(=O)C | | InChi: | InChI=1S/C14H16N2O4S/c1-10(17)15-8-9-16-13-6-2-5-12-11(13)4-3-7-14(12)21(18,19)20/h2-7,16H,8-9H2,1H3,(H,15,17)(H,18,19,20) | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | 5-{[2-(acetylamino)ethyl]amino}naphthalene-1-sulfonic acid |
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 | | AEQ | | Name: | methyl 1-propanoyl-3,4-dihydro-2~{H}-quinoline-6-carboxylate | | Formula: | C14 H17 N O3 | | SMILES: | CCC(=O)N1CCCc2cc(ccc12)C(=O)OC | | InChi: | InChI=1S/C14H17NO3/c1-3-13(16)15-8-4-5-10-9-11(14(17)18-2)6-7-12(10)15/h6-7,9H,3-5,8H2,1-2H3 | | Definition date: | 2017-08-18 | | Last modified: | 2024-09-27 | | Release date: | 2018-03-14 | | Identifier: | methyl 1-propanoyl-3,4-dihydro-2~{H}-quinoline-6-carboxylate |
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