![W6O W6O](https://data.pdbj.org/pdbjplus/data/cc/svg/W6O.svg) | W6O | Name: | (3~{a}~{R},6~{a}~{S})-~{N}-[(2,4-dichlorophenyl)methyl]-2-(4-methylphenyl)sulfonyl-3,3~{a},4,5,6,6~{a}-hexahydro-1~{H}-cyclopenta[c]pyrrole-5-carboxamide | Formula: | C22 H24 Cl2 N2 O3 S | SMILES: | Cc1ccc(cc1)[S](=O)(=O)N2C[CH]3CC(C[CH]3C2)C(=O)NCc4ccc(Cl)cc4Cl | InChi: | InChI=1S/C22H24Cl2N2O3S/c1-14-2-6-20(7-3-14)30(28,29)26-12-17-8-16(9-18(17)13-26)22(27)25-11-15-4-5-19(23)10-21(15)24/h2-7,10,16-18H,8-9,11-13H2,1H3,(H,25,27)/t16-,17+,18- | Definition date: | 2023-09-26 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | (3~{a}~{R},6~{a}~{S})-~{N}-[(2,4-dichlorophenyl)methyl]-2-(4-methylphenyl)sulfonyl-3,3~{a},4,5,6,6~{a}-hexahydro-1~{H}-cyclopenta[c]pyrrole-5-carboxamide |
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![WJ5 WJ5](https://data.pdbj.org/pdbjplus/data/cc/svg/WJ5.svg) | WJ5 | Name: | (3~{a}~{R},6~{a}~{S})-~{N}-[(2,4-dichlorophenyl)methyl]-5-(4-methylphenyl)sulfonyl-1,3,3~{a},4,6,6~{a}-hexahydropyrrolo[3,4-c]pyrrole-2-carboxamide | Formula: | C21 H23 Cl2 N3 O3 S | SMILES: | Cc1ccc(cc1)[S](=O)(=O)N2C[CH]3CN(C[CH]3C2)C(=O)NCc4ccc(Cl)cc4Cl | InChi: | InChI=1S/C21H23Cl2N3O3S/c1-14-2-6-19(7-3-14)30(28,29)26-12-16-10-25(11-17(16)13-26)21(27)24-9-15-4-5-18(22)8-20(15)23/h2-8,16-17H,9-13H2,1H3,(H,24,27)/t16-,17+ | Synonyms: | 1''-3'gc(etheno)ADPR | Definition date: | 2023-10-05 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | (3~{a}~{R},6~{a}~{S})-~{N}-[(2,4-dichlorophenyl)methyl]-5-(4-methylphenyl)sulfonyl-1,3,3~{a},4,6,6~{a}-hexahydropyrrolo[3,4-c]pyrrole-2-carboxamide |
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![WN9 WN9](https://data.pdbj.org/pdbjplus/data/cc/svg/WN9.svg) | WN9 | Name: | [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] (2S)-2-azanyl-3-methyl-butanoate | Formula: | C15 H23 N6 O8 P | SMILES: | CC(C)[CH](N)C(=O)O[P](O)(=O)OC[CH]1O[CH]([CH](O)[CH]1O)n2cnc3c(N)ncnc23 | InChi: | InChI=1S/C15H23N6O8P/c1-6(2)8(16)15(24)29-30(25,26)27-3-7-10(22)11(23)14(28-7)21-5-20-9-12(17)18-4-19-13(9)21/h4-8,10-11,14,22-23H,3,16H2,1-2H3,(H,25,26)(H2,17,18,19)/t7-,8+,10-,11-,14-/m1/s1 | Synonyms: | Valyl adenylate | Definition date: | 2023-10-11 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | [[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] (2~{S})-2-azanyl-3-methyl-butanoate |
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![WTV WTV](https://data.pdbj.org/pdbjplus/data/cc/svg/WTV.svg) | WTV | Name: | N-[(benzyloxy)carbonyl]-4-fluoro-L-phenylalanyl-N-{(2R)-1-[(2R)-oxolan-2-yl]-3-[(3R)-2-oxooxolan-3-yl]propan-2-yl}-L-leucinamide | Formula: | C34 H44 F N3 O7 | SMILES: | Fc1ccc(cc1)CC(NC(=O)OCc1ccccc1)C(=O)NC(CC(C)C)C(=O)NC(CC1CCCO1)CC1CCOC1=O | InChi: | InChI=1S/C34H44FN3O7/c1-22(2)17-29(31(39)36-27(20-28-9-6-15-43-28)19-25-14-16-44-33(25)41)37-32(40)30(18-23-10-12-26(35)13-11-23)38-34(42)45-21-24-7-4-3-5-8-24/h3-5,7-8,10-13,22,25,27-30H,6,9,14-21H2,1-2H3,(H,36,39)(H,37,40)(H,38,42)/t25-,27+,28+,29-,30-/m0/s1 | Definition date: | 2023-10-12 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | N-[(benzyloxy)carbonyl]-4-fluoro-L-phenylalanyl-N-{(2R)-1-[(2R)-oxolan-2-yl]-3-[(3R)-2-oxooxolan-3-yl]propan-2-yl}-L-leucinamide |
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![5X6 5X6](https://data.pdbj.org/pdbjplus/data/cc/svg/5X6.svg) | 5X6 | Name: | (1~{R})-3,5,5-trimethyl-4-[(1~{E},3~{E},5~{E},7~{E},9~{E},11~{E},13~{E},15~{E},17~{E})-3,7,12,16-tetramethyl-18-[(4~{R}
)-2,6,6-trimethyl-4-oxidanyl-cyclohexen-1-yl]octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-3-en-1-ol | Formula: | C40 H56 O2 | SMILES: | CC(=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)C[CH](O)CC1(C)C)C=CC=C(C)C=CC2=C(C)C[CH](O)CC2(C)C | InChi: | InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-24,35-36,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36-/m1/s1 | Synonyms: | Zeaxanthin | Definition date: | 2015-12-17 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | (1~{R})-3,5,5-trimethyl-4-[(1~{E},3~{E},5~{E},7~{E},9~{E},11~{E},13~{E},15~{E},17~{E})-3,7,12,16-tetramethyl-18-[(4~{R})-2,6,6-trimethyl-4-oxidanyl-cyclohexen-1-yl]octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-3-en-1-ol |
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![WXQ WXQ](https://data.pdbj.org/pdbjplus/data/cc/svg/WXQ.svg) | WXQ | Name: | N-{4-[4-amino-5-(4-methoxyphenyl)-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl}prop-2-enamide | Formula: | C23 H21 N5 O2 | SMILES: | C=CC(=O)Nc1ccc(cc1)c1c(c2c(N)ncnc2n1C)c1ccc(OC)cc1 | InChi: | InChI=1S/C23H21N5O2/c1-4-18(29)27-16-9-5-15(6-10-16)21-19(14-7-11-17(30-3)12-8-14)20-22(24)25-13-26-23(20)28(21)2/h4-13H,1H2,2-3H3,(H,27,29)(H2,24,25,26) | Definition date: | 2023-05-22 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | N-{4-[4-amino-5-(4-methoxyphenyl)-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl}prop-2-enamide |
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![WXW WXW](https://data.pdbj.org/pdbjplus/data/cc/svg/WXW.svg) | WXW | Name: | (13S,16R,19S)-16-benzyl-43-ethoxy-N-methyl-7,11,14,17-tetraoxo-13-phenyl-5-oxa-2,8,12,15,18-pentaaza-1(1,4),4(1,2)-dibenzena-9(1,4)-cyclohexanacycloicosaphane-19-carboxamide | Formula: | C46 H54 N6 O7 | SMILES: | CCOc1cccc2CNc3ccc(C[CH](NC(=O)[CH](Cc4ccccc4)NC(=O)[CH](NC(=O)CC5CCC(CC5)NC(=O)COc12)c6ccccc6)C(=O)NC)cc3 | InChi: | InChI=1S/C46H54N6O7/c1-3-58-39-16-10-15-34-28-48-35-21-17-31(18-22-35)26-37(44(55)47-2)50-45(56)38(25-30-11-6-4-7-12-30)51-46(57)42(33-13-8-5-9-14-33)52-40(53)27-32-19-23-36(24-20-32)49-41(54)29-59-43(34)39/h4-18,21-22,32,36-38,42,48H,3,19-20,23-29H2,1-2H3,(H,47,55)(H,49,54)(H,50,56)(H,51,57)(H,52,53)/t32-,36-,37-,38+,42+/m0/s1 | Synonyms: | 4-O-BETA-METHYL-D-GLUCOPYRANOSYL CELLOBIONOLACTAM OXIME | Definition date: | 2023-10-17 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 |
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![WYR WYR](https://data.pdbj.org/pdbjplus/data/cc/svg/WYR.svg) | WYR | Name: | N-[(benzyloxy)carbonyl]-4-fluoro-L-phenylalanyl-N-{(2S,3R)-3-hydroxy-4-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]-4-[(propan-2-yl)amino]butan-2-yl}-L-leucinamide | Formula: | C34 H46 F N5 O7 | SMILES: | Fc1ccc(cc1)CC(NC(=O)OCc1ccccc1)C(=O)NC(CC(C)C)C(=O)NC(CC1CCNC1=O)C(O)C(=O)NC(C)C | InChi: | InChI=1S/C34H46FN5O7/c1-20(2)16-27(31(43)38-26(18-24-14-15-36-30(24)42)29(41)33(45)37-21(3)4)39-32(44)28(17-22-10-12-25(35)13-11-22)40-34(46)47-19-23-8-6-5-7-9-23/h5-13,20-21,24,26-29,41H,14-19H2,1-4H3,(H,36,42)(H,37,45)(H,38,43)(H,39,44)(H,40,46)/t24-,26-,27-,28-,29+/m0/s1 | Synonyms: | GSK3487016A | Definition date: | 2023-10-17 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | N-[(benzyloxy)carbonyl]-4-fluoro-L-phenylalanyl-N-{(2S,3R)-3-hydroxy-4-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]-4-[(propan-2-yl)amino]butan-2-yl}-L-leucinamide |
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![J3O J3O](https://data.pdbj.org/pdbjplus/data/cc/svg/J3O.svg) | J3O | Name: | propan-2-yl 2-[4-(4-chlorophenyl)carbonylphenoxy]-2-methyl-propanoate | Formula: | C20 H21 Cl O4 | SMILES: | CC(C)OC(=O)C(C)(C)Oc1ccc(cc1)C(=O)c2ccc(Cl)cc2 | InChi: | InChI=1S/C20H21ClO4/c1-13(2)24-19(23)20(3,4)25-17-11-7-15(8-12-17)18(22)14-5-9-16(21)10-6-14/h5-13H,1-4H3 | Definition date: | 2023-08-07 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | propan-2-yl 2-[4-(4-chlorophenyl)carbonylphenoxy]-2-methyl-propanoate |
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![HZ6 HZ6](https://data.pdbj.org/pdbjplus/data/cc/svg/HZ6.svg) | HZ6 | Name: | 1-{3-[(4-amino-1-tert-butyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl)oxy]azetidin-1-yl}propan-1-one | Formula: | C15 H22 N6 O2 | SMILES: | CCC(=O)N1CC(C1)Oc1nn(c2ncnc(N)c21)C(C)(C)C | InChi: | InChI=1S/C15H22N6O2/c1-5-10(22)20-6-9(7-20)23-14-11-12(16)17-8-18-13(11)21(19-14)15(2,3)4/h8-9H,5-7H2,1-4H3,(H2,16,17,18) | Definition date: | 2023-07-24 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | 1-{3-[(4-amino-1-tert-butyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl)oxy]azetidin-1-yl}propan-1-one |
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![A1H29 A1H29](https://data.pdbj.org/pdbjplus/data/cc/svg/A1H29.svg) | A1H29 | Name: | (2~{R},3~{R},4~{S},5~{S})-2-(6-aminopurin-9-yl)-5-[2-(1~{H}-1,2,3-triazol-4-yl)ethylsulfanylmethyl]oxolane-3,4-diol | Formula: | C14 H18 N8 O3 S | SMILES: | Nc1ncnc2n(cnc12)[CH]3O[CH](CSCCc4c[nH]nn4)[CH](O)[CH]3O | InChi: | InChI=1S/C14H18N8O3S/c15-12-9-13(17-5-16-12)22(6-18-9)14-11(24)10(23)8(25-14)4-26-2-1-7-3-19-21-20-7/h3,5-6,8,10-11,14,23-24H,1-2,4H2,(H2,15,16,17)(H,19,20,21) | Definition date: | 2024-02-01 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | (2~{R},3~{R},4~{S},5~{S})-2-(6-aminopurin-9-yl)-5-[2-(1~{H}-1,2,3-triazol-4-yl)ethylsulfanylmethyl]oxolane-3,4-diol |
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![A1H3A A1H3A](https://data.pdbj.org/pdbjplus/data/cc/svg/A1H3A.svg) | A1H3A | Name: | 5-[[(2~{S},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methylsulfanylmethyl]-2-chloranyl-benzoic acid | Formula: | C18 H18 Cl N5 O5 S | SMILES: | Nc1ncnc2n(cnc12)[CH]3O[CH](CSCc4ccc(Cl)c(c4)C(O)=O)[CH](O)[CH]3O | InChi: | InChI=1S/C18H18ClN5O5S/c19-10-2-1-8(3-9(10)18(27)28)4-30-5-11-13(25)14(26)17(29-11)24-7-23-12-15(20)21-6-22-16(12)24/h1-3,6-7,11,13-14,17,25-26H,4-5H2,(H,27,28)(H2,20,21,22)/t11-,13-,14-,17-/m1/s1 | Definition date: | 2024-02-01 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | 5-[[(2~{S},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methylsulfanylmethyl]-2-chloranyl-benzoic acid |
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![A1H3B A1H3B](https://data.pdbj.org/pdbjplus/data/cc/svg/A1H3B.svg) | A1H3B | Name: | 3-[[(2~{S},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methylsulfanylmethyl]-5-(4-hydroxyphenyl)benzoic acid | Formula: | C24 H23 N5 O6 S | SMILES: | Nc1ncnc2n(cnc12)[CH]3O[CH](CSCc4cc(cc(c4)c5ccc(O)cc5)C(O)=O)[CH](O)[CH]3O | InChi: | InChI=1S/C24H23N5O6S/c25-21-18-22(27-10-26-21)29(11-28-18)23-20(32)19(31)17(35-23)9-36-8-12-5-14(7-15(6-12)24(33)34)13-1-3-16(30)4-2-13/h1-7,10-11,17,19-20,23,30-32H,8-9H2,(H,33,34)(H2,25,26,27) | Definition date: | 2024-02-01 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | 3-[[(2~{S},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methylsulfanylmethyl]-5-(4-hydroxyphenyl)benzoic acid |
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![A1H3D A1H3D](https://data.pdbj.org/pdbjplus/data/cc/svg/A1H3D.svg) | A1H3D | Name: | 3-[[(2~{S},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methylsulfanylmethyl]benzoic acid | Formula: | C18 H19 N5 O5 S | SMILES: | Nc1ncnc2n(cnc12)[CH]3O[CH](CSCc4cccc(c4)C(O)=O)[CH](O)[CH]3O | InChi: | InChI=1S/C18H19N5O5S/c19-15-12-16(21-7-20-15)23(8-22-12)17-14(25)13(24)11(28-17)6-29-5-9-2-1-3-10(4-9)18(26)27/h1-4,7-8,11,13-14,17,24-25H,5-6H2,(H,26,27)(H2,19,20,21) | Definition date: | 2024-02-01 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | 3-[[(2~{S},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methylsulfanylmethyl]benzoic acid |
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![A1H3E A1H3E](https://data.pdbj.org/pdbjplus/data/cc/svg/A1H3E.svg) | A1H3E | Name: | 3-[[(2~{S},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methylsulfanylmethyl]-5-(3-oxidanylprop-1-ynyl)benzoic acid | Formula: | C21 H23 N5 O6 S | SMILES: | Nc1ncnc2n(cnc12)[CH]3O[CH](CSCc4cc(C=CCO)cc(c4)C(O)=O)[CH](O)[CH]3O | InChi: | InChI=1S/C21H23N5O6S/c22-18-15-19(24-9-23-18)26(10-25-15)20-17(29)16(28)14(32-20)8-33-7-12-4-11(2-1-3-27)5-13(6-12)21(30)31/h1-2,4-6,9-10,14,16-17,20,27-29H,3,7-8H2,(H,30,31)(H2,22,23,24)/b2-1+/t14-,16-,17-,20-/m1/s1 | Definition date: | 2024-02-01 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | 3-[[(2~{S},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methylsulfanylmethyl]-5-[(~{E})-3-oxidanylprop-1-enyl]benzoic acid |
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![XC8 XC8](https://data.pdbj.org/pdbjplus/data/cc/svg/XC8.svg) | XC8 | Name: | 4'-fluoro-6-(trifluoromethyl)[1,1'-biphenyl]-2-yl 2-acetamido-2-deoxy-beta-D-galactopyranoside | Formula: | C21 H21 F4 N O6 | SMILES: | FC(F)(F)c1cccc(OC2OC(CO)C(O)C(O)C2NC(C)=O)c1c1ccc(F)cc1 | InChi: | InChI=1S/C21H21F4NO6/c1-10(28)26-17-19(30)18(29)15(9-27)32-20(17)31-14-4-2-3-13(21(23,24)25)16(14)11-5-7-12(22)8-6-11/h2-8,15,17-20,27,29-30H,9H2,1H3,(H,26,28)/t15-,17-,18+,19-,20-/m1/s1 | Definition date: | 2023-10-30 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | 4'-fluoro-6-(trifluoromethyl)[1,1'-biphenyl]-2-yl 2-acetamido-2-deoxy-beta-D-galactopyranoside |
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![XKU XKU](https://data.pdbj.org/pdbjplus/data/cc/svg/XKU.svg) | XKU | Name: | 1-{(4M)-4-[2-{[1-(cyclopropanesulfonyl)piperidin-4-yl]amino}-5-(trifluoromethyl)pyrimidin-4-yl]-1H-pyrazol-1-yl}-2-methylpropan-2-ol | Formula: | C20 H27 F3 N6 O3 S | SMILES: | O=S(=O)(C1CC1)N1CCC(Nc2nc(c3cn(CC(C)(C)O)nc3)c(cn2)C(F)(F)F)CC1 | InChi: | InChI=1S/C20H27F3N6O3S/c1-19(2,30)12-28-11-13(9-25-28)17-16(20(21,22)23)10-24-18(27-17)26-14-5-7-29(8-6-14)33(31,32)15-3-4-15/h9-11,14-15,30H,3-8,12H2,1-2H3,(H,24,26,27) | Definition date: | 2023-11-03 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | 1-{(4M)-4-[2-{[1-(cyclopropanesulfonyl)piperidin-4-yl]amino}-5-(trifluoromethyl)pyrimidin-4-yl]-1H-pyrazol-1-yl}-2-methylpropan-2-ol |
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![XWH XWH](https://data.pdbj.org/pdbjplus/data/cc/svg/XWH.svg) | XWH | Name: | 4-[3-(trifluoromethyl)-1H-pyrazol-5-yl]pyridine | Formula: | C9 H6 F3 N3 | SMILES: | FC(F)(F)c1cc([NH]n1)c1ccncc1 | InChi: | InChI=1S/C9H6F3N3/c10-9(11,12)8-5-7(14-15-8)6-1-3-13-4-2-6/h1-5H,(H,14,15) | Definition date: | 2023-11-14 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | 4-[3-(trifluoromethyl)-1H-pyrazol-5-yl]pyridine |
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![XWZ XWZ](https://data.pdbj.org/pdbjplus/data/cc/svg/XWZ.svg) | XWZ | Name: | 5-bromopyridin-3-amine | Formula: | C5 H5 Br N2 | SMILES: | Nc1cncc(Br)c1 | InChi: | InChI=1S/C5H5BrN2/c6-4-1-5(7)3-8-2-4/h1-3H,7H2 | Definition date: | 2023-11-14 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | 5-bromopyridin-3-amine |
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![XXN XXN](https://data.pdbj.org/pdbjplus/data/cc/svg/XXN.svg) | XXN | Name: | (3S)-4,7-dichloro-3-hydroxy-1,3-dihydro-2H-indol-2-one | Formula: | C8 H5 Cl2 N O2 | SMILES: | Clc1ccc(Cl)c2c1NC(=O)C2O | InChi: | InChI=1S/C8H5Cl2NO2/c9-3-1-2-4(10)6-5(3)7(12)8(13)11-6/h1-2,7,12H,(H,11,13)/t7-/m0/s1 | Definition date: | 2023-11-14 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | (3S)-4,7-dichloro-3-hydroxy-1,3-dihydro-2H-indol-2-one |
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![XZ6 XZ6](https://data.pdbj.org/pdbjplus/data/cc/svg/XZ6.svg) | XZ6 | Name: | 7-(hydroxymethyl)-3-methyl-6~{H}-[1,3]thiazolo[3,2-a]pyrimidin-5-one | Formula: | C8 H9 N2 O2 S | SMILES: | Cc1csc2N=C(CO)CC(=O)[n]12 | InChi: | InChI=1S/C8H9N2O2S/c1-5-4-13-8-9-6(3-11)2-7(12)10(5)8/h4,11H,2-3H2,1H3 | Definition date: | 2023-11-14 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | 7-(hydroxymethyl)-3-methyl-6~{H}-[1,3]thiazolo[3,2-a]pyrimidin-5-one |
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![XZE XZE](https://data.pdbj.org/pdbjplus/data/cc/svg/XZE.svg) | XZE | Name: | (pyridin-2-yl)(quinolin-2-yl)methanone | Formula: | C15 H10 N2 O | SMILES: | O=C(c1ccc2ccccc2n1)c1ccccn1 | InChi: | InChI=1S/C15H10N2O/c18-15(13-7-3-4-10-16-13)14-9-8-11-5-1-2-6-12(11)17-14/h1-10H | Definition date: | 2023-11-14 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | (pyridin-2-yl)(quinolin-2-yl)methanone |
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![XZI XZI](https://data.pdbj.org/pdbjplus/data/cc/svg/XZI.svg) | XZI | Name: | N,N-dimethyl-2-[(naphthalen-2-yl)oxy]acetamide | Formula: | C14 H15 N O2 | SMILES: | CN(C)C(=O)COc1ccc2ccccc2c1 | InChi: | InChI=1S/C14H15NO2/c1-15(2)14(16)10-17-13-8-7-11-5-3-4-6-12(11)9-13/h3-9H,10H2,1-2H3 | Definition date: | 2023-11-14 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | N,N-dimethyl-2-[(naphthalen-2-yl)oxy]acetamide |
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![XZO XZO](https://data.pdbj.org/pdbjplus/data/cc/svg/XZO.svg) | XZO | Name: | 1-(3,5-dichlorophenyl)pyrrolidine-2,5-dione | Formula: | C10 H7 Cl2 N O2 | SMILES: | Clc1cc(Cl)cc(c1)N1C(=O)CCC1=O | InChi: | InChI=1S/C10H7Cl2NO2/c11-6-3-7(12)5-8(4-6)13-9(14)1-2-10(13)15/h3-5H,1-2H2 | Definition date: | 2023-11-14 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | 1-(3,5-dichlorophenyl)pyrrolidine-2,5-dione |
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![XZT XZT](https://data.pdbj.org/pdbjplus/data/cc/svg/XZT.svg) | XZT | Name: | 1-(2,4-difluorophenyl)pyrrolidine-2,5-dione | Formula: | C10 H7 F2 N O2 | SMILES: | Fc1cc(F)c(cc1)N1C(=O)CCC1=O | InChi: | InChI=1S/C10H7F2NO2/c11-6-1-2-8(7(12)5-6)13-9(14)3-4-10(13)15/h1-2,5H,3-4H2 | Definition date: | 2023-11-14 | Last modified: | 2024-02-09 | Release date: | 2024-02-14 | Identifier: | 1-(2,4-difluorophenyl)pyrrolidine-2,5-dione |
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