![JXD JXD](https://data.pdbj.org/pdbjplus/data/cc/svg/JXD.svg) | JXD | Name: | 2-(acetylamino)-4-O-[2-(acetylamino)-2-deoxy-beta-D-mannopyranosyl]-2-deoxy-1-O-[(S)-{[(R)-{[(2Z,6Z,10Z,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl]oxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-alpha-D-glucopyranose | Formula: | C46 H78 N2 O17 P2 | SMILES: | C1(O)C(O)C(C(OC1CO)OC2C(O)C(C(OC2CO)OP(=O)(OP(O)(OC[C@H]=C(CC[C@H]=C(C)CC[C@H]=C(CCC=C(CCC=C(/C)CC[C@H]=C(C)C)C)C)C)=O)O)NC(C)=O)NC(C)=O | InChi: | InChI=1S/C46H78N2O17P2/c1-29(2)15-10-16-30(3)17-11-18-31(4)19-12-20-32(5)21-13-22-33(6)23-14-24-34(7)25-26-60-66(56,57)65-67(58,59)64-46-40(48-36(9)52)43(55)44(38(28-50)62-46)63-45-39(47-35(8)51)42(54)41(53)37(27-49)61-45/h15,17,19,21,23,25,37-46,49-50,53-55H,10-14,16,18,20,22,24,26-28H2,1-9H3,(H,47,51)(H,48,52)(H,56,57)(H,58,59)/b30-17+,31-19+,32-21-,33-23-,34-25-/t37-,38-,39+,40-,41-,42-,43-,44-,45+,46-/m1/s1 | Definition date: | 2018-10-09 | Last modified: | 2018-10-12 | Release date: | 2018-10-17 | Identifier: | 2-(acetylamino)-4-O-[2-(acetylamino)-2-deoxy-beta-D-mannopyranosyl]-2-deoxy-1-O-[(S)-{[(R)-{[(2Z,6Z,10Z,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl]oxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-alpha-D-glucopyranose |
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![9Z9 9Z9](https://data.pdbj.org/pdbjplus/data/cc/svg/9Z9.svg) | 9Z9 | Name: | (3beta,14beta,17beta,25R)-3-[4-methoxy-3-(methoxymethyl)butoxy]spirost-5-en | Formula: | C34 H56 O5 | SMILES: | CC34C2C(OC1(OCC(CC1)C)C2C)CC3C5C(CC4)C6(C)C(=CC5)CC(CC6)OCCC(COC)COC | InChi: | InChI=1S/C34H56O5/c1-22-9-15-34(38-19-22)23(2)31-30(39-34)18-29-27-8-7-25-17-26(37-16-12-24(20-35-5)21-36-6)10-13-32(25,3)28(27)11-14-33(29,31)4/h7,22-24,26-31H,8-21H2,1-6H3/t22-,23+,26+,27-,28+,29+,30+,31+,32+,33+,34-/m1/s1 | Definition date: | 2018-09-07 | Last modified: | 2018-10-05 | Release date: | 2018-10-10 | Identifier: | (3beta,14beta,17beta,25R)-3-[4-methoxy-3-(methoxymethyl)butoxy]spirost-5-en |
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![F8D F8D](https://data.pdbj.org/pdbjplus/data/cc/svg/F8D.svg) | F8D | Name: | 1-[(3S,3aS,8bS)-7-chloro-3-(hydroxymethyl)-2,3,3a,8b-tetrahydro-1H-[1]benzofuro[3,2-b]pyrrol-1-yl]ethan-1-one | Formula: | C13 H14 Cl N O3 | SMILES: | c1cc3c(cc1Cl)C2N(C(C)=O)CC(C2O3)CO | InChi: | InChI=1S/C13H14ClNO3/c1-7(17)15-5-8(6-16)13-12(15)10-4-9(14)2-3-11(10)18-13/h2-4,8,12-13,16H,5-6H2,1H3/t8-,12-,13-/m0/s1 | Definition date: | 2018-03-13 | Last modified: | 2018-10-05 | Release date: | 2018-10-10 | Identifier: | 1-[(3S,3aS,8bS)-7-chloro-3-(hydroxymethyl)-2,3,3a,8b-tetrahydro-1H-[1]benzofuro[3,2-b]pyrrol-1-yl]ethan-1-one |
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![GDH GDH](https://data.pdbj.org/pdbjplus/data/cc/svg/GDH.svg) | GDH | Name: | 7-[2-methoxy-6-[(4-methylpyridin-2-yl)methoxy]phenyl]-2,3,4,5-tetrahydro-1~{H}-3-benzazepine | Formula: | C24 H26 N2 O2 | SMILES: | COc1cccc(OCc2cc(C)ccn2)c1c3ccc4CCNCCc4c3 | InChi: | InChI=1S/C24H26N2O2/c1-17-8-13-26-21(14-17)16-28-23-5-3-4-22(27-2)24(23)20-7-6-18-9-11-25-12-10-19(18)15-20/h3-8,13-15,25H,9-12,16H2,1-2H3 | Definition date: | 2018-09-12 | Last modified: | 2018-10-05 | Release date: | 2018-10-10 | Identifier: | 7-[2-methoxy-6-[(4-methylpyridin-2-yl)methoxy]phenyl]-2,3,4,5-tetrahydro-1~{H}-3-benzazepine |
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![GUY GUY](https://data.pdbj.org/pdbjplus/data/cc/svg/GUY.svg) | GUY | Name: | ~{N}-(1-propyl-1,2,3,4-tetrazol-5-yl)furan-2-carboxamide | Formula: | C9 H11 N5 O2 | SMILES: | CCCn1nnnc1NC(=O)c2occc2 | InChi: | InChI=1S/C9H11N5O2/c1-2-5-14-9(11-12-13-14)10-8(15)7-4-3-6-16-7/h3-4,6H,2,5H2,1H3,(H,10,11,13,15) | Definition date: | 2018-06-01 | Last modified: | 2018-10-05 | Release date: | 2018-10-10 | Identifier: | ~{N}-(1-propyl-1,2,3,4-tetrazol-5-yl)furan-2-carboxamide |
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![GV1 GV1](https://data.pdbj.org/pdbjplus/data/cc/svg/GV1.svg) | GV1 | Name: | ~{N},~{N},5,6-tetramethylthieno[2,3-d]pyrimidin-4-amine | Formula: | C10 H13 N3 S | SMILES: | CN(C)c1ncnc2sc(C)c(C)c12 | InChi: | InChI=1S/C10H13N3S/c1-6-7(2)14-10-8(6)9(13(3)4)11-5-12-10/h5H,1-4H3 | Definition date: | 2018-06-01 | Last modified: | 2018-10-05 | Release date: | 2018-10-10 | Identifier: | ~{N},~{N},5,6-tetramethylthieno[2,3-d]pyrimidin-4-amine |
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![B4T B4T](https://data.pdbj.org/pdbjplus/data/cc/svg/B4T.svg) | B4T | Name: | mono-PEGylated sulfonatocalix[4]arene | Formula: | C63 H94 O33 S4 | SMILES: | O=S(O)(=O)c1cc3c(c(c1)Cc2cc(cc(c2O)Cc5c(c(Cc4c(c(C3)cc(S(=O)(O)=O)c4)OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)cc(S(O)(=O)=O)c5)O)S(O)(=O)=O)O | InChi: | InChI=1S/C63H94O33S4/c1-79-2-3-80-4-5-81-6-7-82-8-9-83-10-11-84-12-13-85-14-15-86-16-17-87-18-19-88-20-21-89-22-23-90-24-25-91-26-27-92-28-29-93-30-31-94-32-33-95-34-35-96-63-54-38-52-44-57(98(70,71)72)42-50(61(52)65)36-48-40-56(97(67,68)69)41-49(60(48)64)37-51-43-58(99(73,74)75)45-53(62(51)66)39-55(63)47-59(46-54)100(76,77)78/h40-47,64-66H,2-39H2,1H3,(H,67,68,69)(H,70,71,72)(H,73,74,75)(H,76,77,78) | Definition date: | 2017-09-14 | Last modified: | 2018-10-05 | Release date: | 2018-10-10 | Identifier: | 25-[(2,5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50-heptadecaoxadopentacontan-52-yl)oxy]-26,27,28-trihydroxypentacyclo[19.3.1.1~3,7~.1~9,13~.1~15,19~]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene-5,11,17,23-tetrasulfonic acid |
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![JJY JJY](https://data.pdbj.org/pdbjplus/data/cc/svg/JJY.svg) | JJY | Name: | 3,4,6,7-tetrahydroacridine-1,8(2H,5H)-dione | Formula: | C13 H13 N O2 | SMILES: | C2CC(c3cc1C(=O)CCCc1nc3C2)=O | InChi: | InChI=1S/C13H13NO2/c15-12-5-1-3-10-8(12)7-9-11(14-10)4-2-6-13(9)16/h7H,1-6H2 | Definition date: | 2018-09-11 | Last modified: | 2018-10-05 | Release date: | 2018-10-10 | Identifier: | 3,4,6,7-tetrahydroacridine-1,8(2H,5H)-dione |
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![JK7 JK7](https://data.pdbj.org/pdbjplus/data/cc/svg/JK7.svg) | JK7 | Name: | N-[(1S,2S,3S,4R)-3-hydroxy-1,2,3,4-tetrahydro-1,4-epoxynaphthalen-2-yl]cyclobutanecarboxamide | Formula: | C15 H17 N O3 | SMILES: | C4C(C(NC1C(C2c3ccccc3C1O2)O)=O)CC4 | InChi: | InChI=1S/C15H17NO3/c17-12-11(16-15(18)8-4-3-5-8)13-9-6-1-2-7-10(9)14(12)19-13/h1-2,6-8,11-14,17H,3-5H2,(H,16,18)/t11-,12-,13-,14+/m0/s1 | Definition date: | 2018-09-11 | Last modified: | 2018-10-05 | Release date: | 2018-10-10 | Identifier: | N-[(1S,2S,3S,4R)-3-hydroxy-1,2,3,4-tetrahydro-1,4-epoxynaphthalen-2-yl]cyclobutanecarboxamide |
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![JMY JMY](https://data.pdbj.org/pdbjplus/data/cc/svg/JMY.svg) | JMY | Name: | 1-[(3S,3aS,8bS)-5-fluoro-3-(hydroxymethyl)-2,3,3a,8b-tetrahydro-1H-[1]benzofuro[3,2-b]pyrrol-1-yl]ethan-1-one | Formula: | C13 H14 F N O3 | SMILES: | c1cc(c2c(c1)C3N(C(C)=O)CC(C3O2)CO)F | InChi: | InChI=1S/C13H14FNO3/c1-7(17)15-5-8(6-16)12-11(15)9-3-2-4-10(14)13(9)18-12/h2-4,8,11-12,16H,5-6H2,1H3/t8-,11-,12-/m0/s1 | Definition date: | 2018-09-11 | Last modified: | 2018-10-05 | Release date: | 2018-10-10 | Identifier: | 1-[(3S,3aS,8bS)-5-fluoro-3-(hydroxymethyl)-2,3,3a,8b-tetrahydro-1H-[1]benzofuro[3,2-b]pyrrol-1-yl]ethan-1-one |
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![JP7 JP7](https://data.pdbj.org/pdbjplus/data/cc/svg/JP7.svg) | JP7 | Name: | (6aR,12aR)-3-methoxy-6a,10,11,12a-tetrahydro-6H,7H,9H-[1]benzopyrano[4,3-c]pyrazolo[1,2-a]pyrazol-9-one | Formula: | C14 H16 N2 O3 | SMILES: | C2N4C(CCN4C3c1ccc(OC)cc1OCC23)=O | InChi: | InChI=1S/C14H16N2O3/c1-18-10-2-3-11-12(6-10)19-8-9-7-16-13(17)4-5-15(16)14(9)11/h2-3,6,9,14H,4-5,7-8H2,1H3/t9-,14+/m0/s1 | Definition date: | 2018-09-12 | Last modified: | 2018-10-05 | Release date: | 2018-10-10 | Identifier: | (6aR,12aR)-3-methoxy-6a,10,11,12a-tetrahydro-6H,7H,9H-[1]benzopyrano[4,3-c]pyrazolo[1,2-a]pyrazol-9-one |
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![JQD JQD](https://data.pdbj.org/pdbjplus/data/cc/svg/JQD.svg) | JQD | Name: | (6aS,12aR)-3-methoxy-6a,10,11,12a-tetrahydro-6H,7H,9H-[1]benzopyrano[4,3-c]pyrazolo[1,2-a]pyrazol-9-one | Formula: | C14 H16 N2 O3 | SMILES: | C2N4N(C3c1ccc(OC)cc1OCC23)CCC4=O | InChi: | InChI=1S/C14H16N2O3/c1-18-10-2-3-11-12(6-10)19-8-9-7-16-13(17)4-5-15(16)14(9)11/h2-3,6,9,14H,4-5,7-8H2,1H3/t9-,14-/m1/s1 | Definition date: | 2018-09-12 | Last modified: | 2018-10-05 | Release date: | 2018-10-10 | Identifier: | (6aS,12aR)-3-methoxy-6a,10,11,12a-tetrahydro-6H,7H,9H-[1]benzopyrano[4,3-c]pyrazolo[1,2-a]pyrazol-9-one |
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![H94 H94](https://data.pdbj.org/pdbjplus/data/cc/svg/H94.svg) | H94 | Name: | 6-{4-[(4R)-4-hydroxy-6-oxo-4-(trifluoromethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]pyridin-3-yl]piperidin-1-yl}-4-(trifluoromethyl)pyridine-3-carbonitrile | Formula: | C19 H16 F6 N6 O2 | SMILES: | c3(C1CCN(CC1)c2cc(C(F)(F)F)c(C#N)cn2)nnc4c3C(C(F)(F)F)(O)CC(N4)=O | InChi: | InChI=1S/C19H16F6N6O2/c20-18(21,22)11-5-12(27-8-10(11)7-26)31-3-1-9(2-4-31)15-14-16(30-29-15)28-13(32)6-17(14,33)19(23,24)25/h5,8-9,33H,1-4,6H2,(H2,28,29,30,32)/t17-/m1/s1 | Definition date: | 2018-06-18 | Last modified: | 2018-09-28 | Release date: | 2018-10-03 | Identifier: | 6-{4-[(4R)-4-hydroxy-6-oxo-4-(trifluoromethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]pyridin-3-yl]piperidin-1-yl}-4-(trifluoromethyl)pyridine-3-carbonitrile |
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![UOA UOA](https://data.pdbj.org/pdbjplus/data/cc/svg/UOA.svg) | UOA | Name: | [(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3-hydroxy-2,4-dimethoxytetrahydrofuran-2-yl]methyl dihydrogen phosphate (non-preferred name) | Formula: | C11 H17 N2 O10 P | SMILES: | COC1C(OC(C1O)(OC)COP(O)(=O)O)N2C(NC(=O)C=C2)=O | InChi: | InChI=1S/C11H17N2O10P/c1-20-7-8(15)11(21-2,5-22-24(17,18)19)23-9(7)13-4-3-6(14)12-10(13)16/h3-4,7-9,15H,5H2,1-2H3,(H,12,14,16)(H2,17,18,19)/t7-,8+,9-,11-/m1/s1 | Definition date: | 2018-04-06 | Last modified: | 2018-09-27 | Release date: | 2018-08-29 | Identifier: | [(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3-hydroxy-2,4-dimethoxytetrahydrofuran-2-yl]methyl dihydrogen phosphate (non-preferred name) |
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![UPR UPR](https://data.pdbj.org/pdbjplus/data/cc/svg/UPR.svg) | UPR | Name: | 2'-DEOXYURIDINE-5'-ALPHA,BETA-AMINOPHOSPHORANE-TRIPHOSPHATE | Formula: | C9 H18 N3 O14 P3 | SMILES: | P(O)(O)(O)(NP(=O)(O)OP(=O)(O)O)OCC1OC(CC1O)N2C(=O)NC(=O)C=C2 | InChi: | InChI=1S/C9H18N3O14P3/c13-5-3-8(12-2-1-7(14)10-9(12)15)25-6(5)4-24-29(21,22,23)11-27(16,17)26-28(18,19)20/h1-2,5-6,8,13,21-23H,3-4H2,(H,10,14,15)(H2,11,16,17)(H2,18,19,20)/t5-,6+,8+/m0/s1 | Definition date: | 2003-12-26 | Last modified: | 2018-09-25 | Identifier: | 2'-deoxy-5'-O-[(3R)-1,1,1,3-tetrahydroxy-3-oxo-3-(phosphonooxy)-1lambda~5~,3lambda~5~-diphosphazan-1-yl]uridine |
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![E0M E0M](https://data.pdbj.org/pdbjplus/data/cc/svg/E0M.svg) | E0M | Name: | 2-amino-7-(propan-2-yl)-3-(1H-tetrazol-5-yl)-5H-[1]benzopyrano[2,3-b]pyridin-5-one | Formula: | C16 H14 N6 O2 | SMILES: | CC(C)c4ccc1c(C(c2c(O1)nc(c(c2)c3nnnn3)N)=O)c4 | InChi: | InChI=1S/C16H14N6O2/c1-7(2)8-3-4-12-9(5-8)13(23)10-6-11(15-19-21-22-20-15)14(17)18-16(10)24-12/h3-7H,1-2H3,(H2,17,18)(H,19,20,21,22) | Definition date: | 2017-11-20 | Last modified: | 2018-09-21 | Release date: | 2018-09-26 | Identifier: | 2-amino-7-(propan-2-yl)-3-(1H-tetrazol-5-yl)-5H-[1]benzopyrano[2,3-b]pyridin-5-one |
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![E0S E0S](https://data.pdbj.org/pdbjplus/data/cc/svg/E0S.svg) | E0S | Name: | 2-amino-5-oxo-7-(propan-2-yl)-N-(1H-tetrazol-5-yl)-5H-[1]benzopyrano[2,3-b]pyridine-3-carboxamide | Formula: | C17 H15 N7 O3 | SMILES: | CC(C)c4ccc1c(C(c2c(O1)nc(c(c2)C(Nc3nnnn3)=O)N)=O)c4 | InChi: | InChI=1S/C17H15N7O3/c1-7(2)8-3-4-12-9(5-8)13(25)10-6-11(14(18)19-16(10)27-12)15(26)20-17-21-23-24-22-17/h3-7H,1-2H3,(H2,18,19)(H2,20,21,22,23,24,26) | Definition date: | 2017-11-20 | Last modified: | 2018-09-21 | Release date: | 2018-09-26 | Identifier: | 2-amino-5-oxo-7-(propan-2-yl)-N-(1H-tetrazol-5-yl)-5H-[1]benzopyrano[2,3-b]pyridine-3-carboxamide |
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![FQ8 FQ8](https://data.pdbj.org/pdbjplus/data/cc/svg/FQ8.svg) | FQ8 | Name: | [(2~{R},3~{S},4~{S})-2,3,4,5-tetrakis(oxidanyl)pentyl] [(2~{R},3~{R},4~{S})-2,3,4-tris(oxidanyl)-5-[oxidanyl-[(2~{R},3~{S},4~{S})-2,3,4-tris(oxidanyl)-5-phosphonooxy-pentoxy]phosphoryl]oxy-pentyl] hydrogen phosphate | Formula: | C15 H35 O22 P3 | SMILES: | OC[CH](O)[CH](O)[CH](O)CO[P](O)(=O)OC[CH](O)[CH](O)[CH](O)CO[P](O)(=O)OC[CH](O)[CH](O)[CH](O)CO[P](O)(O)=O | InChi: | InChI=1S/C15H35O22P3/c16-1-7(17)13(23)9(19)3-34-39(29,30)36-5-11(21)15(25)12(22)6-37-40(31,32)35-4-10(20)14(24)8(18)2-33-38(26,27)28/h7-25H,1-6H2,(H,29,30)(H,31,32)(H2,26,27,28)/t7-,8-,9+,10+,11+,12-,13-,14-,15+/m0/s1 | Definition date: | 2018-07-23 | Last modified: | 2018-09-21 | Release date: | 2018-09-26 | Identifier: | [(2~{R},3~{S},4~{S})-2,3,4,5-tetrakis(oxidanyl)pentyl] [(2~{R},3~{R},4~{S})-2,3,4-tris(oxidanyl)-5-[oxidanyl-[(2~{R},3~{S},4~{S})-2,3,4-tris(oxidanyl)-5-phosphonooxy-pentoxy]phosphoryl]oxy-pentyl] hydrogen phosphate |
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![FJ7 FJ7](https://data.pdbj.org/pdbjplus/data/cc/svg/FJ7.svg) | FJ7 | Name: | (1S,3R)-1-(3-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid | Formula: | C30 H31 F N4 O3 | SMILES: | c1cccc(c1N2CCN(CC2)Cc3c(OC)ccc(c3)C6c5c(c4ccccc4n5)CC(N6)C(=O)O)F | InChi: | InChI=1S/C30H31FN4O3/c1-38-27-11-10-19(16-20(27)18-34-12-14-35(15-13-34)26-9-5-3-7-23(26)31)28-29-22(17-25(33-28)30(36)37)21-6-2-4-8-24(21)32-29/h2-11,16,25,28,32-33H,12-15,17-18H2,1H3,(H,36,37)/t25-,28+/m1/s1 | Definition date: | 2018-04-02 | Last modified: | 2018-09-14 | Release date: | 2018-09-19 | Identifier: | (1S,3R)-1-(3-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid |
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![FVD FVD](https://data.pdbj.org/pdbjplus/data/cc/svg/FVD.svg) | FVD | Name: | 6-chloro-1-[(4-fluoro-3,5-dimethylphenyl)methyl]-2-(piperazin-1-yl)-4-(1,2,3,6-tetrahydropyridin-4-yl)-1H-benzimidazole | Formula: | C25 H29 Cl F N5 | SMILES: | n3(c2cc(cc(C=1CCNCC=1)c2nc3N4CCNCC4)Cl)Cc5cc(C)c(c(c5)C)F | InChi: | InChI=1S/C25H29ClFN5/c1-16-11-18(12-17(2)23(16)27)15-32-22-14-20(26)13-21(19-3-5-28-6-4-19)24(22)30-25(32)31-9-7-29-8-10-31/h3,11-14,28-29H,4-10,15H2,1-2H3 | Definition date: | 2018-04-20 | Last modified: | 2018-09-14 | Release date: | 2018-09-19 | Identifier: | 6-chloro-1-[(4-fluoro-3,5-dimethylphenyl)methyl]-2-(piperazin-1-yl)-4-(1,2,3,6-tetrahydropyridin-4-yl)-1H-benzimidazole |
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![K7V K7V](https://data.pdbj.org/pdbjplus/data/cc/svg/K7V.svg) | K7V | Name: | neo-Inositol pentakisphosphate | Formula: | C6 H17 O21 P5 | SMILES: | O[CH]1[CH](O[P](O)(O)=O)[CH](O[P](O)(O)=O)[CH](O[P](O)(O)=O)[CH](O[P](O)(O)=O)[CH]1O[P](O)(O)=O | InChi: | InChI=1S/C6H17O21P5/c7-1-2(23-28(8,9)10)4(25-30(14,15)16)6(27-32(20,21)22)5(26-31(17,18)19)3(1)24-29(11,12)13/h1-7H,(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)(H2,20,21,22)/t1-,2+,3-,4-,5+,6- | Definition date: | 2018-01-31 | Last modified: | 2018-09-07 | Release date: | 2018-09-12 | Identifier: | [(1~{S},2~{R},4~{S},5~{R})-3-oxidanyl-2,4,5,6-tetraphosphonooxy-cyclohexyl] dihydrogen phosphate |
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![8SF 8SF](https://data.pdbj.org/pdbjplus/data/cc/svg/8SF.svg) | 8SF | Name: | 1-phenyl-5-propan-2-ylsulfanyl-1,2,3,4-tetrazole | Formula: | C10 H12 N4 S | SMILES: | CC(C)Sc1nnnn1c2ccccc2 | InChi: | InChI=1S/C10H12N4S/c1-8(2)15-10-11-12-13-14(10)9-6-4-3-5-7-9/h3-8H,1-2H3 | Definition date: | 2017-09-09 | Last modified: | 2018-08-31 | Release date: | 2018-09-05 | Identifier: | 1-phenyl-5-propan-2-ylsulfanyl-1,2,3,4-tetrazole |
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![GA7 GA7](https://data.pdbj.org/pdbjplus/data/cc/svg/GA7.svg) | GA7 | Name: | [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2R)-1-{(2S,3S,4R,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl}propan-2-yl hydrogen (R)-phosphate (non-preferred name) | Formula: | C20 H32 N5 O13 P | SMILES: | O=P(O)(OC(CC1C(C(O)C(O)C(C(O)CO)O1)O)C)OCC2C(O)C(O)C(O2)n3cnc4c3ncnc4N | InChi: | InChI=1S/C20H32N5O13P/c1-7(2-9-12(28)14(30)15(31)17(36-9)8(27)3-26)38-39(33,34)35-4-10-13(29)16(32)20(37-10)25-6-24-11-18(21)22-5-23-19(11)25/h5-10,12-17,20,26-32H,2-4H2,1H3,(H,33,34)(H2,21,22,23)/t7-,8+,9+,10-,12-,13-,14-,15+,16-,17-,20-/m1/s1 | Definition date: | 2018-05-17 | Last modified: | 2018-08-31 | Release date: | 2018-09-05 | Identifier: | [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2R)-1-{(2S,3S,4R,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl}propan-2-yl hydrogen (R)-phosphate (non-preferred name) |
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![GZ4 GZ4](https://data.pdbj.org/pdbjplus/data/cc/svg/GZ4.svg) | GZ4 | Name: | 7,8-dimethyl-2,4-dioxo-10-(3-phenylpropyl)-1,2,3,4-tetrahydrobenzo[g]pteridin-10-ium | Formula: | C21 H21 N4 O2 | SMILES: | c13C(NC(=O)Nc1[n+](c2cc(C)c(cc2n3)C)CCCc4ccccc4)=O | InChi: | InChI=1S/C21H20N4O2/c1-13-11-16-17(12-14(13)2)25(10-6-9-15-7-4-3-5-8-15)19-18(22-16)20(26)24-21(27)23-19/h3-5,7-8,11-12H,6,9-10H2,1-2H3,(H,24,26,27)/p+1 | Definition date: | 2018-06-06 | Last modified: | 2018-08-31 | Release date: | 2018-09-05 | Identifier: | 7,8-dimethyl-2,4-dioxo-10-(3-phenylpropyl)-1,2,3,4-tetrahydrobenzo[g]pteridin-10-ium |
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![UOB UOB](https://data.pdbj.org/pdbjplus/data/cc/svg/UOB.svg) | UOB | Name: | 2'-OMe,4'beta-OMe uridine 5'-(dihydrogen phosphate) | Formula: | C11 H17 N2 O10 P | SMILES: | C1(OC(C(C1OC)O)(COP(O)(=O)O)OC)N2C(NC(C=C2)=O)=O | InChi: | InChI=1S/C11H17N2O10P/c1-20-7-8(15)11(21-2,5-22-24(17,18)19)23-9(7)13-4-3-6(14)12-10(13)16/h3-4,7-9,15H,5H2,1-2H3,(H,12,14,16)(H2,17,18,19)/t7-,8+,9-,11+/m1/s1 | Definition date: | 2018-04-06 | Last modified: | 2018-08-24 | Release date: | 2018-08-29 | Identifier: | [(2S,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3-hydroxy-2,4-dimethoxytetrahydrofuran-2-yl]methyl dihydrogen phosphate (non-preferred name) |
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