![HS5 HS5](https://data.pdbj.org/pdbjplus/data/cc/svg/HS5.svg) | HS5 | Name: | 2-[(4-fluorophenyl)sulfonyl-(2-hydroxyethyl)amino]-N-oxo-ethanamide | Formula: | C10 H11 F N2 O5 S | SMILES: | O=S(=O)(c1ccc(F)cc1)N(CC(=O)N=O)CCO | InChi: | InChI=1S/C10H11FN2O5S/c11-8-1-3-9(4-2-8)19(17,18)13(5-6-14)7-10(15)12-16/h1-4,14H,5-7H2 | Synonyms: | 4-fluoro-N-(2-hydroxyethyl)-N-(2-nitroso-2-oxoethyl)benzenesulfonamide | Definition date: | 2008-11-04 | Last modified: | 2021-03-01 | Identifier: | N~2~-[(4-fluorophenyl)sulfonyl]-N~2~-(2-hydroxyethyl)-N-oxoglycinamide |
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![ZMG ZMG](https://data.pdbj.org/pdbjplus/data/cc/svg/ZMG.svg) | ZMG | Name: | (5R)-2-[(2-fluorophenyl)amino]-5-(1-methylethyl)-1,3-thiazol-4(5H)-one | Formula: | C12 H13 F N2 O S | SMILES: | Fc1ccccc1NC2=NC(=O)C(S2)C(C)C | InChi: | InChI=1S/C12H13FN2OS/c1-7(2)10-11(16)15-12(17-10)14-9-6-4-3-5-8(9)13/h3-7,10H,1-2H3,(H,14,15,16)/t10-/m1/s1 | Synonyms: | (R)-2-(2-fluorophenylamino)-5-isopropylthiazol-4(5H)-one | Definition date: | 2008-01-09 | Last modified: | 2021-03-01 | Identifier: | (5R)-2-[(2-fluorophenyl)amino]-5-(1-methylethyl)-1,3-thiazol-4(5H)-one |
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![2M1 2M1](https://data.pdbj.org/pdbjplus/data/cc/svg/2M1.svg) | 2M1 | Name: | N-[(benzyloxy)carbonyl]-L-leucyl-N-[(3S)-5-methyl-1-(methylsulfonyl)hexan-3-yl]-L-leucinamide | Formula: | C28 H47 N3 O6 S | SMILES: | O=S(=O)(C)CCC(NC(=O)C(NC(=O)C(NC(=O)OCc1ccccc1)CC(C)C)CC(C)C)CC(C)C | InChi: | InChI=1S/C28H47N3O6S/c1-19(2)15-23(13-14-38(7,35)36)29-26(32)24(16-20(3)4)30-27(33)25(17-21(5)6)31-28(34)37-18-22-11-9-8-10-12-22/h8-12,19-21,23-25H,13-18H2,1-7H3,(H,29,32)(H,30,33)(H,31,34)/t23-,24+,25+/m1/s1 | Synonyms: | PHQ-Leu-Leu-Leu-vinylsulfone | Definition date: | 2013-12-02 | Last modified: | 2021-03-01 | Release date: | 2014-02-12 | Identifier: | N-[(benzyloxy)carbonyl]-L-leucyl-N-[(3S)-5-methyl-1-(methylsulfonyl)hexan-3-yl]-L-leucinamide |
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![HT6 HT6](https://data.pdbj.org/pdbjplus/data/cc/svg/HT6.svg) | HT6 | Name: | (3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-[(hexylsulfanyl)methyl]pyrrolidin-3-ol | Formula: | C18 H29 N5 O S | SMILES: | OC1C(CSCCCCCC)CN(C1)Cc2cnc3c2ncnc3N | InChi: | InChI=1S/C18H29N5OS/c1-2-3-4-5-6-25-11-14-9-23(10-15(14)24)8-13-7-20-17-16(13)21-12-22-18(17)19/h7,12,14-15,20,24H,2-6,8-11H2,1H3,(H2,19,21,22)/t14-,15+/m1/s1 | Synonyms: | Hexylthio-DADMe-Immucillin-A | Definition date: | 2017-09-11 | Last modified: | 2021-03-01 | Release date: | 2018-09-12 | Identifier: | (3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-[(hexylsulfanyl)methyl]pyrrolidin-3-ol |
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![HTS HTS](https://data.pdbj.org/pdbjplus/data/cc/svg/HTS.svg) | HTS | Name: | 2-MERCAPTOPHENOL | Formula: | C6 H6 O S | SMILES: | c1c(c(ccc1)S)O | InChi: | InChI=1S/C6H6OS/c7-5-3-1-2-4-6(5)8/h1-4,7-8H | Synonyms: | 2-HYDROXYTHIOPHENOL | Definition date: | 2007-02-27 | Last modified: | 2021-03-01 | Identifier: | 2-sulfanylphenol |
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![HTX HTX](https://data.pdbj.org/pdbjplus/data/cc/svg/HTX.svg) | HTX | Name: | heptan-2-one | Formula: | C7 H14 O | SMILES: | CCCCCC(C)=O | InChi: | InChI=1S/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H3 | Synonyms: | 2-heptanone | Definition date: | 2009-11-05 | Last modified: | 2021-03-01 | Identifier: | heptan-2-one |
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![ZOL ZOL](https://data.pdbj.org/pdbjplus/data/cc/svg/ZOL.svg) | ZOL | Name: | ZOLEDRONIC ACID | Formula: | C5 H10 N2 O7 P2 | SMILES: | O=P(O)(O)C(O)(Cn1ccnc1)P(=O)(O)O | InChi: | InChI=1S/C5H10N2O7P2/c8-5(15(9,10)11,16(12,13)14)3-7-2-1-6-4-7/h1-2,4,8H,3H2,(H2,9,10,11)(H2,12,13,14) | Synonyms: | (1-HYDROXY-2-IMIDAZOL-1-YLETHYLIDENE)DIPHOSPHONIC ACID | Definition date: | 2005-06-06 | Last modified: | 2021-03-01 | Identifier: | [1-hydroxy-2-(1H-imidazol-1-yl)ethane-1,1-diyl]bis(phosphonic acid) |
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![ZON ZON](https://data.pdbj.org/pdbjplus/data/cc/svg/ZON.svg) | ZON | Name: | 1-(1,2-benzoxazol-3-yl)methanesulfonamide | Formula: | C8 H8 N2 O3 S | SMILES: | O=S(=O)(N)Cc2noc1ccccc12 | InChi: | InChI=1S/C8H8N2O3S/c9-14(11,12)5-7-6-3-1-2-4-8(6)13-10-7/h1-4H,5H2,(H2,9,11,12) | Synonyms: | Zonisamide | Definition date: | 2010-11-26 | Last modified: | 2021-03-01 | Identifier: | 1-(1,2-benzoxazol-3-yl)methanesulfonamide |
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![ZPH ZPH](https://data.pdbj.org/pdbjplus/data/cc/svg/ZPH.svg) | ZPH | Name: | methyl (2S)-2-{[(R)-[(1R)-1-amino-3-methylbutyl](hydroxy)phosphoryl]oxy}-3-phenylpropanoate | Formula: | C15 H24 N O5 P | SMILES: | O=C(OC)C(OP(=O)(O)C(N)CC(C)C)Cc1ccccc1 | InChi: | InChI=1S/C15H24NO5P/c1-11(2)9-14(16)22(18,19)21-13(15(17)20-3)10-12-7-5-4-6-8-12/h4-8,11,13-14H,9-10,16H2,1-3H3,(H,18,19)/t13-,14+/m0/s1 | Synonyms: | LP(0)PHEOMe | Definition date: | 2010-10-22 | Last modified: | 2021-03-01 | Identifier: | methyl (2S)-2-{[(R)-[(1R)-1-amino-3-methylbutyl](hydroxy)phosphoryl]oxy}-3-phenylpropanoate |
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![2OY 2OY](https://data.pdbj.org/pdbjplus/data/cc/svg/2OY.svg) | 2OY | Name: | N-[(2S,3S)-7-amino-1-chloro-2-hydroxyheptan-3-yl]-4-methylbenzenesulfonamide (Bound Form) | Formula: | C14 H23 Cl N2 O3 S | SMILES: | O=S(=O)(NC(CCCCN)C(O)CCl)c1ccc(cc1)C | InChi: | InChI=1S/C14H23ClN2O3S/c1-11-5-7-12(8-6-11)21(19,20)17-13(14(18)10-15)4-2-3-9-16/h5-8,13-14,17-18H,2-4,9-10,16H2,1H3/t13-,14+/m0/s1 | Synonyms: | Tosyllysine Chloromethyl Ketone (Bound Form) | Definition date: | 2013-12-19 | Last modified: | 2021-03-01 | Release date: | 2014-04-23 | Identifier: | N-[(2S,3S)-7-amino-1-chloro-2-hydroxyheptan-3-yl]-4-methylbenzenesulfonamide |
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![ZPR ZPR](https://data.pdbj.org/pdbjplus/data/cc/svg/ZPR.svg) | ZPR | Name: | N-BENZYLOXYCARBONYL-L-PROLYL-L-PROLINAL | Formula: | C18 H22 N2 O4 | SMILES: | O=C(N1C(C=O)CCC1)C3N(C(=O)OCc2ccccc2)CCC3 | InChi: | InChI=1S/C18H22N2O4/c21-12-15-8-4-10-19(15)17(22)16-9-5-11-20(16)18(23)24-13-14-6-2-1-3-7-14/h1-3,6-7,12,15-16H,4-5,8-11,13H2/t15-,16-/m0/s1 | Synonyms: | Z-PRO-PROLINAL | Definition date: | 1999-07-08 | Last modified: | 2021-03-01 | Identifier: | benzyl (2S)-2-{[(2S)-2-formylpyrrolidin-1-yl]carbonyl}pyrrolidine-1-carboxylate |
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![HWU HWU](https://data.pdbj.org/pdbjplus/data/cc/svg/HWU.svg) | HWU | Name: | (2R,3R,4R,5R,6R)-3-(acetylamino)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-thiopyran-2-yl [(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate | Formula: | C17 H27 N3 O16 P2 S | SMILES: | O=C1C=CN(C(=O)N1)C2OC(C(O)C2O)COP(=O)(OP(=O)(OC3SC(C(O)C(O)C3NC(=O)C)CO)O)O | InChi: | InChI=1S/C17H27N3O16P2S/c1-6(22)18-10-13(26)12(25)8(4-21)39-16(10)35-38(31,32)36-37(29,30)33-5-7-11(24)14(27)15(34-7)20-3-2-9(23)19-17(20)28/h2-3,7-8,10-16,21,24-27H,4-5H2,1H3,(H,18,22)(H,29,30)(H,31,32)(H,19,23,28)/t7-,8-,10-,11-,12+,13-,14-,15-,16?/m1/s1 | Synonyms: | URIDINE DIPHOSPHO-5-THIO-N-ACETYLGALACTOSAMINE | Definition date: | 2014-04-30 | Last modified: | 2021-03-01 | Release date: | 2014-05-28 | Identifier: | (2R,3R,4R,5R,6R)-3-(acetylamino)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-thiopyran-2-yl [(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate (non-preferred name) |
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![4BQ 4BQ](https://data.pdbj.org/pdbjplus/data/cc/svg/4BQ.svg) | 4BQ | Name: | (2S)-2-amino-5-oxo-5-[(4-phenylmethoxyphenyl)amino]pentanoic acid | Formula: | C18 H20 N2 O4 | SMILES: | O=C(O)C(N)CCC(=O)Nc2ccc(OCc1ccccc1)cc2 | InChi: | InChI=1S/C18H20N2O4/c19-16(18(22)23)10-11-17(21)20-14-6-8-15(9-7-14)24-12-13-4-2-1-3-5-13/h1-9,16H,10-12,19H2,(H,20,21)(H,22,23)/t16-/m0/s1 | Synonyms: | N-[4-(phenylmethoxy)phenyl]-L-glutamine | Definition date: | 2008-03-14 | Last modified: | 2021-03-01 | Identifier: | N-[4-(benzyloxy)phenyl]-L-glutamine |
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![4C0 4C0](https://data.pdbj.org/pdbjplus/data/cc/svg/4C0.svg) | 4C0 | Name: | 3-(1H-benzimidazol-2-yl)-N-(3-phenylpropanoyl)-D-alanine | Formula: | C19 H19 N3 O3 | SMILES: | O=C(O)C(NC(=O)CCc1ccccc1)Cc3nc2ccccc2n3 | InChi: | InChI=1S/C19H19N3O3/c23-18(11-10-13-6-2-1-3-7-13)22-16(19(24)25)12-17-20-14-8-4-5-9-15(14)21-17/h1-9,16H,10-12H2,(H,20,21)(H,22,23)(H,24,25)/t16-/m1/s1 | Synonyms: | (R)-3-(1H-Benzoimidazol-2-yl)-2-(3-phenyl-propionylamino)-propionic acid | Definition date: | 2009-10-22 | Last modified: | 2021-03-01 | Identifier: | 3-(1H-benzimidazol-2-yl)-N-(3-phenylpropanoyl)-D-alanine |
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![FXV FXV](https://data.pdbj.org/pdbjplus/data/cc/svg/FXV.svg) | FXV | Name: | METHYL-3-(4'-N-OXOPYRIDYLPHENOYL)-3-METHYL-2-(M-AMIDINOBENZYL)-PROPIONATE | Formula: | C25 H27 N4 O4 | SMILES: | O=C(OC)C(Cc1cc(C(=[NH2+])N)ccc1)C(NC(=O)c3ccc(c2cc[n+]([O-])cc2)cc3)C | InChi: | InChI=1S/C25H26N4O4/c1-16(22(25(31)33-2)15-17-4-3-5-21(14-17)23(26)27)28-24(30)20-8-6-18(7-9-20)19-10-12-29(32)13-11-19/h3-14,16,22H,15H2,1-2H3,(H3,26,27)(H,28,30)/p+1/t16-,22-/m1/s1 | Synonyms: | FXV673 | Definition date: | 2002-01-31 | Last modified: | 2021-03-01 | Identifier: | amino{3-[(2R,3R)-2-(methoxycarbonyl)-3-({[4-(1-oxidopyridin-4-yl)phenyl]carbonyl}amino)butyl]phenyl}methaniminium |
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![4D8 4D8](https://data.pdbj.org/pdbjplus/data/cc/svg/4D8.svg) | 4D8 | Name: | (3beta,4alpha,5beta,14beta)-3-hydroxy-4-methylcholesta-8,24-diene-4-carboxylic acid | Formula: | C29 H46 O3 | SMILES: | O=C(O)C1(C2CCC3=C(C2(CCC1O)C)CCC4(C)C(C(C)CCC=C(/C)C)CCC34)C | InChi: | InChI=1S/C29H46O3/c1-18(2)8-7-9-19(3)21-11-12-22-20-10-13-24-28(5,23(20)14-16-27(21,22)4)17-15-25(30)29(24,6)26(31)32/h8,19,21-22,24-25,30H,7,9-17H2,1-6H3,(H,31,32)/t19-,21-,22+,24-,25+,27-,28-,29+/m1/s1 | Synonyms: | 4alpha-carboxy-4beta-methyl-zymosterol | Definition date: | 2015-01-29 | Last modified: | 2021-03-01 | Release date: | 2015-02-11 | Identifier: | (3beta,4alpha,5beta,14beta)-3-hydroxy-4-methylcholesta-8,24-diene-4-carboxylic acid |
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![FYP FYP](https://data.pdbj.org/pdbjplus/data/cc/svg/FYP.svg) | FYP | Name: | ethyl 8-fluoro-5-methyl-6-oxo-5,6-dihydro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate | Formula: | C15 H14 F N3 O3 | SMILES: | CCOC(c3c2CN(C(c1c(ccc(c1)F)n2cn3)=O)C)=O | InChi: | InChI=1S/C15H14FN3O3/c1-3-22-15(21)13-12-7-18(2)14(20)10-6-9(16)4-5-11(10)19(12)8-17-13/h4-6,8H,3,7H2,1-2H3 | Synonyms: | Flumazenil | Definition date: | 2018-04-25 | Last modified: | 2021-03-01 | Release date: | 2018-06-27 | Identifier: | ethyl 8-fluoro-5-methyl-6-oxo-5,6-dihydro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate |
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![FYU FYU](https://data.pdbj.org/pdbjplus/data/cc/svg/FYU.svg) | FYU | Name: | 2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde | Formula: | C5 H4 N2 O3 | SMILES: | N1C(NC(C(=C1)C=O)=O)=O | InChi: | InChI=1S/C5H4N2O3/c8-2-3-1-6-5(10)7-4(3)9/h1-2H,(H2,6,7,9,10) | Synonyms: | 5-formyluracil | Definition date: | 2015-06-22 | Last modified: | 2021-03-01 | Release date: | 2015-10-21 | Identifier: | 2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde |
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![4DW 4DW](https://data.pdbj.org/pdbjplus/data/cc/svg/4DW.svg) | 4DW | Name: | N-{4-[2-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl}-L-glutamic acid | Formula: | C20 H19 N5 O6 | SMILES: | c1(ccc(cc1)C(=O)NC(C(O)=O)[C@H]=[C@H]C(=O)O)CCc2c3c(nc2)NC(=NC3=O)N | InChi: | InChI=1S/C20H19N5O6/c21-20-24-16-15(18(29)25-20)12(9-22-16)6-3-10-1-4-11(5-2-10)17(28)23-13(19(30)31)7-8-14(26)27/h1-2,4-5,7-9,13H,3,6H2,(H,23,28)(H,26,27)(H,30,31)(H4,21,22,24,25,29)/b8-7+/t13-/m0/s1 | Synonyms: | pemetrexed | Definition date: | 2015-03-05 | Last modified: | 2021-03-01 | Release date: | 2015-12-16 | Identifier: | (2E,4S)-4-({4-[2-(2-amino-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl}amino)pent-2-enedioic acid |
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![4FZ 4FZ](https://data.pdbj.org/pdbjplus/data/cc/svg/4FZ.svg) | 4FZ | Name: | 4-formylbenzenecarboximidamide | Formula: | C8 H8 N2 O | SMILES: | NC(=N)c1ccc(C=O)cc1 | InChi: | InChI=1S/C8H8N2O/c9-8(10)7-3-1-6(5-11)2-4-7/h1-5H,(H3,9,10) | Synonyms: | 4-formylbenzimidamide | Definition date: | 2009-11-19 | Last modified: | 2021-03-01 | Identifier: | 4-methanoylbenzenecarboximidamide |
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![G1R G1R](https://data.pdbj.org/pdbjplus/data/cc/svg/G1R.svg) | G1R | Name: | [(2R,3R,4R,5R)-5-(2-AMINO-6-OXO-1,6-DIHYDRO-9H-PURIN-9-YL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL]METHYL [(2R,3S,4R,5S)-3,4,5-TRIHYDROXYTETRAHYDROFURAN-2-YL]METHYL DIHYDROGEN DIPHOSPHATE | Formula: | C15 H23 N5 O15 P2 | SMILES: | O=C4NC(=Nc1c4ncn1C2OC(C(O)C2O)COP(=O)(O)OP(=O)(O)OCC3OC(O)C(O)C3O)N | InChi: | InChI=1S/C15H23N5O15P2/c16-15-18-11-6(12(25)19-15)17-3-20(11)13-9(23)7(21)4(33-13)1-31-36(27,28)35-37(29,30)32-2-5-8(22)10(24)14(26)34-5/h3-5,7-10,13-14,21-24,26H,1-2H2,(H,27,28)(H,29,30)(H3,16,18,19,25)/t4-,5-,7+,8-,9-,10-,13-,14+/m1/s1 | Synonyms: | GUANOSINE DIPHOSPHORIBOSE | Definition date: | 2006-08-30 | Last modified: | 2021-03-01 | Identifier: | [(2R,3R,4R,5R)-5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl [(2R,3S,4R,5S)-3,4,5-trihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate (non-preferred name) |
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![G23 G23](https://data.pdbj.org/pdbjplus/data/cc/svg/G23.svg) | G23 | Name: | (2R,4S)-2-[(R)-BENZYLCARBAMOYL-PHENYLACETYL-METHYL]-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID | Formula: | C23 H27 N3 O4 S | SMILES: | O=C(NC(C(=O)NCc1ccccc1)C2SC(C(N2)C(=O)O)(C)C)Cc3ccccc3 | InChi: | InChI=1S/C23H27N3O4S/c1-23(2)19(22(29)30)26-21(31-23)18(20(28)24-14-16-11-7-4-8-12-16)25-17(27)13-15-9-5-3-6-10-15/h3-12,18-19,21,26H,13-14H2,1-2H3,(H,24,28)(H,25,27)(H,29,30)/t18-,19+,21-/m1/s1 | Synonyms: | GR123976 | Definition date: | 1999-07-08 | Last modified: | 2021-03-01 | Identifier: | (2R,4S)-2-{(1R)-2-(benzylamino)-2-oxo-1-[(phenylacetyl)amino]ethyl}-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid |
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![G2K G2K](https://data.pdbj.org/pdbjplus/data/cc/svg/G2K.svg) | G2K | Name: | 2-{(2S)-1-[(2-chlorophenoxy)acetyl]pyrrolidin-2-yl}-5-hydroxy-6-oxo-N-(2-phenylethyl)-1,6-dihydropyrimidine-4-carboxamide | Formula: | C25 H25 Cl N4 O5 | SMILES: | C2(=O)C(O)=C(C(=O)NCCc1ccccc1)N=C(N2)C3CCCN3C(COc4ccccc4Cl)=O | InChi: | InChI=1S/C25H25ClN4O5/c26-17-9-4-5-11-19(17)35-15-20(31)30-14-6-10-18(30)23-28-21(22(32)25(34)29-23)24(33)27-13-12-16-7-2-1-3-8-16/h1-5,7-9,11,18,32H,6,10,12-15H2,(H,27,33)(H,28,29,34)/t18-/m0/s1 | Synonyms: | SRI-29843 | Definition date: | 2017-07-11 | Last modified: | 2021-03-01 | Release date: | 2018-01-03 | Identifier: | 2-{(2S)-1-[(2-chlorophenoxy)acetyl]pyrrolidin-2-yl}-5-hydroxy-6-oxo-N-(2-phenylethyl)-1,6-dihydropyrimidine-4-carboxamide |
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![G2R G2R](https://data.pdbj.org/pdbjplus/data/cc/svg/G2R.svg) | G2R | Name: | [(2R,3R,4R,5R)-5-(2-AMINO-6-OXO-1,6-DIHYDRO-9H-PURIN-9-YL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL]METHYL [(2R,3S,4S)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL]METHYL DIHYDROGEN DIPHOSPHATE | Formula: | C15 H23 N5 O14 P2 | SMILES: | O=P(O)(OCC1OCC(O)C1O)OP(=O)(O)OCC4OC(n3cnc2c3N=C(N)NC2=O)C(O)C4O | InChi: | InChI=1S/C15H23N5O14P2/c16-15-18-12-8(13(25)19-15)17-4-20(12)14-11(24)10(23)7(33-14)3-32-36(28,29)34-35(26,27)31-2-6-9(22)5(21)1-30-6/h4-7,9-11,14,21-24H,1-3H2,(H,26,27)(H,28,29)(H3,16,18,19,25)/t5-,6+,7+,9-,10-,11+,14+/m0/s1 | Synonyms: | GUANOSINE DIPHOSPHORIBOSE INTERMEDIATE | Definition date: | 2006-08-30 | Last modified: | 2021-03-01 | Identifier: | [(2R,3R,4R,5R)-5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl [(2R,3S,4S)-3,4-dihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate (non-preferred name) |
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![G3K G3K](https://data.pdbj.org/pdbjplus/data/cc/svg/G3K.svg) | G3K | Name: | 2-{(2R)-1-[2-(4-chlorophenoxy)-2-methylpropanoyl]pyrrolidin-2-yl}-5-hydroxy-6-oxo-1,6-dihydropyrimidine-4-carboxylic acid | Formula: | C19 H20 Cl N3 O6 | SMILES: | C1(NC(=NC(=C1O)C(O)=O)C3CCCN3C(=O)C(C)(C)Oc2ccc(Cl)cc2)=O | InChi: | InChI=1S/C19H20ClN3O6/c1-19(2,29-11-7-5-10(20)6-8-11)18(28)23-9-3-4-12(23)15-21-13(17(26)27)14(24)16(25)22-15/h5-8,12,24H,3-4,9H2,1-2H3,(H,26,27)(H,21,22,25)/t12-/m1/s1 | Synonyms: | SRI-29782 | Definition date: | 2017-07-11 | Last modified: | 2021-03-01 | Release date: | 2018-01-03 | Identifier: | 2-{(2R)-1-[2-(4-chlorophenoxy)-2-methylpropanoyl]pyrrolidin-2-yl}-5-hydroxy-6-oxo-1,6-dihydropyrimidine-4-carboxylic acid |
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