 | | GD1 | | Name: | 2-amino-5-[(Z)-iminomethyl]-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one | | Formula: | C7 H7 N5 O | | SMILES: | O=C1c2c(cnc2N=C(N)N1)C=[N@H] | | InChi: | InChI=1S/C7H7N5O/c8-1-3-2-10-5-4(3)6(13)12-7(9)11-5/h1-2,8H,(H4,9,10,11,12,13)/b8-1- | | Synonyms: | 7-cyano-7-deazaguanine, bound form | | Definition date: | 2012-05-25 | | Last modified: | 2024-09-27 | | Identifier: | 2-amino-5-[(Z)-iminomethyl]-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one |
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 | | GD7 | | Name: | (1R)-1,2,2-TRIMETHYLPROPYL (R)-METHYLPHOSPHINATE | | Formula: | C7 H17 O2 P | | SMILES: | O=P(OC(C)C(C)(C)C)C | | InChi: | InChI=1S/C7H17O2P/c1-6(7(2,3)4)9-10(5)8/h6,10H,1-5H3/t6-/m1/s1 | | Definition date: | 2006-07-27 | | Last modified: | 2024-09-27 | | Identifier: | (1R)-1,2,2-trimethylpropyl (R)-methylphosphinate |
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 | | GD8 | | Name: | (1R)-1,2,2-TRIMETHYLPROPYL (S)-METHYLPHOSPHINATE | | Formula: | C7 H17 O2 P | | SMILES: | O=P(OC(C)C(C)(C)C)C | | InChi: | InChI=1S/C7H17O2P/c1-6(7(2,3)4)9-10(5)8/h6,10H,1-5H3/t6-/m1/s1 | | Definition date: | 2009-04-15 | | Last modified: | 2024-09-27 | | Identifier: | (1R)-1,2,2-trimethylpropyl (S)-methylphosphinate |
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 | | 4E0 | | Name: | 1-[butyl(fluoranyl)phosphoryl]oxyhexadecane | | Formula: | C20 H42 F O2 P | | SMILES: | CCCCCCCCCCCCCCCCO[P](F)(=O)CCCC | | InChi: | InChI=1S/C20H42FO2P/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-23-24(21,22)20-6-4-2/h3-20H2,1-2H3/t24-/m0/s1 | | Definition date: | 2021-07-01 | | Last modified: | 2024-09-27 | | Release date: | 2021-09-15 | | Identifier: | 1-[butyl(fluoranyl)phosphoryl]oxyhexadecane |
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 | | 4E4 | | Name: | 2-ethyl-2-(hydroxymethyl)-N-(6-methylpyridin-3-yl)butanamide | | Formula: | C13 H20 N2 O2 | | SMILES: | C(C)C(CO)(C(=O)Nc1cnc(C)cc1)CC | | InChi: | InChI=1S/C13H20N2O2/c1-4-13(5-2,9-16)12(17)15-11-7-6-10(3)14-8-11/h6-8,16H,4-5,9H2,1-3H3,(H,15,17) | | Definition date: | 2015-03-06 | | Last modified: | 2024-09-27 | | Release date: | 2016-06-29 | | Identifier: | 2-ethyl-2-(hydroxymethyl)-N-(6-methylpyridin-3-yl)butanamide |
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 | | GDI | | Name: | (2S)-N-[(2S)-1-AZANYLIDENE-3-[4-(4-CYANOPHENYL)PHENYL]PROPAN-2-YL]PIPERIDINE-2-CARBOXAMIDE | | Formula: | C22 H24 N4 O | | SMILES: | O=C(NC(C=[N@H])Cc2ccc(c1ccc(C#N)cc1)cc2)C3NCCCC3 | | InChi: | InChI=1S/C22H24N4O/c23-14-17-6-10-19(11-7-17)18-8-4-16(5-9-18)13-20(15-24)26-22(27)21-3-1-2-12-25-21/h4-11,15,20-21,24-25H,1-3,12-13H2,(H,26,27)/b24-15+/t20-,21-/m0/s1 | | Definition date: | 2013-10-31 | | Last modified: | 2024-09-27 | | Release date: | 2014-03-19 | | Identifier: | (2S)-N-[(2S,3E)-1-(4'-cyanobiphenyl-4-yl)-3-iminopropan-2-yl]piperidine-2-carboxamide |
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 | | GDP | | Name: | GUANOSINE-5'-DIPHOSPHATE | | Formula: | C10 H15 N5 O11 P2 | | SMILES: | O=P(O)(O)OP(=O)(O)OCC3OC(n2cnc1c2N=C(N)NC1=O)C(O)C3O | | InChi: | InChI=1S/C10H15N5O11P2/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(25-9)1-24-28(22,23)26-27(19,20)21/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H2,19,20,21)(H3,11,13,14,18)/t3-,5-,6-,9-/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | guanosine 5'-(trihydrogen diphosphate) |
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 | | GDS | | Name: | OXIDIZED GLUTATHIONE DISULFIDE | | Formula: | C20 H32 N6 O12 S2 | | SMILES: | O=C(NC(C(=O)NCC(=O)O)CSSCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)CCC(C(=O)O)N | | InChi: | InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/t9-,10-,11-,12-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | (2S,2'S)-5,5'-[disulfanediylbis({(2R)-3-[(carboxymethyl)amino]-3-oxopropane-1,2-diyl}imino)]bis(2-amino-5-oxopentanoic acid) (non-preferred name) |
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 | | GDT | | Name: | (2E,4E)-N-[(2S,3R)-3-hydroxy-1-[[(3Z,5S,8S,10S)-10-hydroxy-5-methyl-2,7-dioxo-1,6-diazacyclododec-3-en-8-yl]amino]-1-ox
obutan-2-yl]dodeca-2,4-dienamide | | Formula: | C27 H44 N4 O6 | | SMILES: | O=C(C=CC=CCCCCCCC)NC(C(=O)NC1C(=O)NC(C=CC(=O)NCCC(O)C1)C)C(O)C | | InChi: | InChI=1S/C27H44N4O6/c1-4-5-6-7-8-9-10-11-12-13-24(35)31-25(20(3)32)27(37)30-22-18-21(33)16-17-28-23(34)15-14-19(2)29-26(22)36/h10-15,19-22,25,32-33H,4-9,16-18H2,1-3H3,(H,28,34)(H,29,36)(H,30,37)(H,31,35)/b11-10+,13-12+,15-14+/t19-,20+,21-,22-,25-/m0/s1 | | Synonyms: | Glidobactin A | | Definition date: | 2007-11-20 | | Last modified: | 2024-09-27 | | Identifier: | (2E,4E)-N-[(1S,2R)-2-hydroxy-1-{[(3E,5S,8S,10S)-10-hydroxy-5-methyl-2,7-dioxo-1,6-diazacyclododec-3-en-8-yl]carbamoyl}propyl]dodeca-2,4-dienamide |
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 | | 4EM | | Name: | (3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(1H-pyrrol-2-ylcarbonyl)amino]ethyl}amino)propyl]amino}butyl dihydrogen phosphate | | Formula: | C16 H27 N4 O8 P | | SMILES: | P(OCC(C(C(NCCC(=O)NCCNC(=O)c1cccn1)=O)O)(C)C)(O)(O)=O | | InChi: | InChI=1S/C16H27N4O8P/c1-16(2,10-28-29(25,26)27)13(22)15(24)19-7-5-12(21)18-8-9-20-14(23)11-4-3-6-17-11/h3-4,6,13,17,22H,5,7-10H2,1-2H3,(H,18,21)(H,19,24)(H,20,23)(H2,25,26,27)/t13-/m0/s1 | | Definition date: | 2015-07-21 | | Last modified: | 2024-09-27 | | Release date: | 2015-09-16 | | Identifier: | (3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(1H-pyrrol-2-ylcarbonyl)amino]ethyl}amino)propyl]amino}butyl dihydrogen phosphate |
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 | | 4EY | | Name: | 3-methanethioyl-1-(5-O-phosphono-beta-D-ribofuranosyl)-5-(sulfanylcarbonyl)pyridin-1-ium | | Formula: | C12 H15 N O8 P S2 | | SMILES: | O=C(S)c1cc(c[n+](c1)C1OC(COP(=O)(O)O)C(O)C1O)C=S | | InChi: | InChI=1S/C12H14NO8PS2/c14-9-8(4-20-22(17,18)19)21-11(10(9)15)13-2-6(5-23)1-7(3-13)12(16)24/h1-3,5,8-11,14-15H,4H2,(H2-,16,17,18,19,24)/p+1/t8-,9-,10-,11-/m1/s1 | | Synonyms: | Dithiodinicotinic acid mononucleotide | | Definition date: | 2015-03-13 | | Last modified: | 2024-09-27 | | Release date: | 2015-07-15 | | Identifier: | 3-methanethioyl-1-(5-O-phosphono-beta-D-ribofuranosyl)-5-(sulfanylcarbonyl)pyridin-1-ium |
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 | | GE8 | | Name: | 2-(4-chloranylphenoxy)-2-methyl-~{N}-(3-sulfanylpropyl)propanamide | | Formula: | C13 H18 Cl N O2 S | | SMILES: | CC(C)(Oc1ccc(Cl)cc1)C(=O)NCCCS | | InChi: | InChI=1S/C13H18ClNO2S/c1-13(2,12(16)15-8-3-9-18)17-11-6-4-10(14)5-7-11/h4-7,18H,3,8-9H2,1-2H3,(H,15,16) | | Definition date: | 2018-09-13 | | Last modified: | 2024-09-27 | | Release date: | 2019-02-27 | | Identifier: | 2-(4-chloranylphenoxy)-2-methyl-~{N}-(3-sulfanylpropyl)propanamide |
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 | | GEB | | Name: | 3-[4-(3-oxidanylidenepropyl)piperazin-1-yl]propanal | | Formula: | C10 H18 N2 O2 | | SMILES: | O=CCCN1CCN(CCC=O)CC1 | | InChi: | InChI=1S/C10H18N2O2/c13-9-1-3-11-5-7-12(8-6-11)4-2-10-14/h9-10H,1-8H2 | | Definition date: | 2018-09-13 | | Last modified: | 2024-09-27 | | Release date: | 2019-02-06 | | Identifier: | 3-[4-(3-oxidanylidenepropyl)piperazin-1-yl]propanal |
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 | | 4F3 | | Name: | [2-(1-AMINO-2-HYDROXY-PROPYL)-4-(4-FLUORO-1H-INDOL-3-YLMETHYL)-5-HYDROXY-IMIDAZOL-1-YL]-ACETIC ACID | | Formula: | C17 H19 F N4 O4 | | SMILES: | O=C(O)Cn1c(O)c(nc1C(N)C(O)C)Cc3c2c(F)cccc2nc3 | | InChi: | InChI=1S/C17H19FN4O4/c1-8(23)15(19)16-21-12(17(26)22(16)7-13(24)25)5-9-6-20-11-4-2-3-10(18)14(9)11/h2-4,6,8,15,20,23,26H,5,7,19H2,1H3,(H,24,25)/t8-,15-/m0/s1 | | Definition date: | 2003-12-16 | | Last modified: | 2024-09-27 | | Identifier: | {2-[(1R,2S)-1-amino-2-hydroxypropyl]-4-[(4-fluoro-1H-indol-3-yl)methyl]-5-hydroxy-1H-imidazol-1-yl}acetic acid |
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 | | GEG | | Name: | (4E)-4-AMINOHEX-4-ENOIC ACID | | Formula: | C6 H11 N O2 | | SMILES: | O=C(O)CCC(=C/C)N | | InChi: | InChI=1S/C6H11NO2/c1-2-5(7)3-4-6(8)9/h2H,3-4,7H2,1H3,(H,8,9)/b5-2+ | | Definition date: | 2003-06-03 | | Last modified: | 2024-09-27 | | Identifier: | (4E)-4-aminohex-4-enoic acid |
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 | | GEH | | Name: | 2-(4-chloranylphenoxy)-2-methyl-~{N}-(2-sulfanylethyl)propanamide | | Formula: | C12 H16 Cl N O2 S | | SMILES: | CC(C)(Oc1ccc(Cl)cc1)C(=O)NCCS | | InChi: | InChI=1S/C12H16ClNO2S/c1-12(2,11(15)14-7-8-17)16-10-5-3-9(13)4-6-10/h3-6,17H,7-8H2,1-2H3,(H,14,15) | | Definition date: | 2018-09-13 | | Last modified: | 2024-09-27 | | Release date: | 2019-02-27 | | Identifier: | 2-(4-chloranylphenoxy)-2-methyl-~{N}-(2-sulfanylethyl)propanamide |
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 | | 4FB | | Name: | (4S)-4-FLUORO-L-PROLINE | | Formula: | C5 H8 F N O2 | | SMILES: | O=C(O)C1NCC(F)C1 | | InChi: | InChI=1S/C5H8FNO2/c6-3-1-4(5(8)9)7-2-3/h3-4,7H,1-2H2,(H,8,9)/t3-,4-/m0/s1 | | Definition date: | 2007-06-06 | | Last modified: | 2024-09-27 | | Identifier: | (4S)-4-fluoro-L-proline |
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 | | GER | | Name: | GERAN-8-YL GERAN | | Formula: | C20 H34 | | SMILES: | C(=C/CCC(=C/C)/C)(CC/C=C(/CC/C=C(C)C)C)C | | InChi: | InChI=1S/C20H34/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h7,11,14-15H,8-10,12-13,16H2,1-6H3/b18-7+,19-15+,20-14+ | | Definition date: | 2000-01-19 | | Last modified: | 2024-09-27 | | Identifier: | (6E,10E,14E)-2,6,10,14-tetramethylhexadeca-2,6,10,14-tetraene |
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 | | 4FO | | Name: | (2R)-2,4-diaminobutanoic acid | | Formula: | C4 H10 N2 O2 | | SMILES: | NC(CCN)C(=O)O | | InChi: | InChI=1S/C4H10N2O2/c5-2-1-3(6)4(7)8/h3H,1-2,5-6H2,(H,7,8)/t3-/m1/s1 | | Definition date: | 2015-08-03 | | Last modified: | 2024-09-27 | | Release date: | 2016-09-21 | | Identifier: | (2R)-2,4-diaminobutanoic acid |
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 | | 4FU | | Name: | (1R,2S)-cyclohexane-1,2-dicarboxylic acid | | Formula: | C8 H12 O4 | | SMILES: | C(=O)(O)C1C(CCCC1)C(O)=O | | InChi: | InChI=1S/C8H12O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12)/t5-,6+ | | Definition date: | 2015-08-04 | | Last modified: | 2024-09-27 | | Release date: | 2015-10-28 | | Identifier: | (1R,2S)-cyclohexane-1,2-dicarboxylic acid |
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 | | 4FW | | Name: | 4-FLUOROTRYPTOPHANE | | Formula: | C11 H11 F N2 O2 | | SMILES: | O=C(O)C(N)Cc2c1c(F)cccc1nc2 | | InChi: | InChI=1S/C11H11FN2O2/c12-7-2-1-3-9-10(7)6(5-14-9)4-8(13)11(15)16/h1-3,5,8,14H,4,13H2,(H,15,16)/t8-/m0/s1 | | Definition date: | 2003-12-16 | | Last modified: | 2024-09-27 | | Identifier: | 4-fluoro-L-tryptophan |
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 | | GF8 | | Name: | 2-(3,4-dichlorophenyl)-~{N}-(2-sulfanylethyl)ethanamide | | Formula: | C10 H11 Cl2 N O S | | SMILES: | SCCNC(=O)Cc1ccc(Cl)c(Cl)c1 | | InChi: | InChI=1S/C10H11Cl2NOS/c11-8-2-1-7(5-9(8)12)6-10(14)13-3-4-15/h1-2,5,15H,3-4,6H2,(H,13,14) | | Definition date: | 2018-09-14 | | Last modified: | 2024-09-27 | | Release date: | 2019-02-27 | | Identifier: | 2-(3,4-dichlorophenyl)-~{N}-(2-sulfanylethyl)ethanamide |
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 | | 4G6 | | Name: | 2-methylpropane-1,2-diamine | | Formula: | C4 H12 N2 | | SMILES: | CC(C)(N)CN | | InChi: | InChI=1S/C4H12N2/c1-4(2,6)3-5/h3,5-6H2,1-2H3 | | Definition date: | 2015-08-04 | | Last modified: | 2024-09-27 | | Release date: | 2015-10-28 | | Identifier: | 2-methylpropane-1,2-diamine |
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 | | 4G9 | | Name: | 2-chloro-N-[4-chloro-3-(dimethylsulfamoyl)phenyl]acetamide | | Formula: | C10 H12 Cl2 N2 O3 S | | SMILES: | Clc1c(cc(cc1)NC(=O)CCl)S(=O)(N(C)C)=O | | InChi: | InChI=1S/C10H12Cl2N2O3S/c1-14(2)18(16,17)9-5-7(3-4-8(9)12)13-10(15)6-11/h3-5H,6H2,1-2H3,(H,13,15) | | Definition date: | 2015-03-17 | | Last modified: | 2024-09-27 | | Release date: | 2016-10-12 | | Identifier: | 2-chloro-N-[4-chloro-3-(dimethylsulfamoyl)phenyl]acetamide |
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 | | 4GB | | Name: | N-{5-(azepan-1-ylsulfonyl)-2-[(ethylsulfanyl)methoxy]phenyl}acetamide | | Formula: | C17 H26 N2 O4 S2 | | SMILES: | O=S(c1ccc(OCSCC)c(c1)NC(=O)C)(=O)N2CCCCCC2 | | InChi: | InChI=1S/C17H26N2O4S2/c1-3-24-13-23-17-9-8-15(12-16(17)18-14(2)20)25(21,22)19-10-6-4-5-7-11-19/h8-9,12H,3-7,10-11,13H2,1-2H3,(H,18,20) | | Definition date: | 2015-03-17 | | Last modified: | 2024-09-27 | | Release date: | 2016-10-12 | | Identifier: | N-{5-(azepan-1-ylsulfonyl)-2-[(ethylsulfanyl)methoxy]phenyl}acetamide |
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