![TNA TNA](https://data.pdbj.org/pdbjplus/data/cc/svg/TNA.svg) | TNA | Name: | N-[(3S)-3-{[(3S)-3-amino-3-carboxypropyl]amino}-3-carboxypropyl]-L-glutamic acid | Formula: | C13 H23 N3 O8 | SMILES: | O=C(O)C(NCCC(NCCC(N)C(=O)O)C(=O)O)CCC(=O)O | InChi: | InChI=1S/C13H23N3O8/c14-7(11(19)20)3-5-15-9(13(23)24)4-6-16-8(12(21)22)1-2-10(17)18/h7-9,15-16H,1-6,14H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)/t7-,8-,9-/m0/s1 | Synonyms: | thermonicotianamine | Definition date: | 2009-01-07 | Last modified: | 2020-06-17 | Identifier: | N-[(3S)-3-{[(3S)-3-amino-3-carboxypropyl]amino}-3-carboxypropyl]-L-glutamic acid |
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![B49 B49](https://data.pdbj.org/pdbjplus/data/cc/svg/B49.svg) | B49 | Name: | N-[2-(diethylamino)ethyl]-5-[(Z)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carbo
xamide | Formula: | C22 H27 F N4 O2 | SMILES: | O=C(NCCN(CC)CC)c1c(c(nc1C)/C=C3/c2cc(F)ccc2NC3=O)C | InChi: | InChI=1S/C22H27FN4O2/c1-5-27(6-2)10-9-24-22(29)20-13(3)19(25-14(20)4)12-17-16-11-15(23)7-8-18(16)26-21(17)28/h7-8,11-12,25H,5-6,9-10H2,1-4H3,(H,24,29)(H,26,28)/b17-12- | Synonyms: | SUNITINIB | Definition date: | 2009-01-29 | Last modified: | 2020-06-17 | Identifier: | N-[2-(diethylamino)ethyl]-5-[(Z)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide |
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![TNE TNE](https://data.pdbj.org/pdbjplus/data/cc/svg/TNE.svg) | TNE | Name: | 8-METHYL-8-AZABICYCLO[3,2,1]OCTAN-3-ONE | Formula: | C8 H13 N O | SMILES: | O=C1CC2N(C)C(C1)CC2 | InChi: | InChI=1S/C8H13NO/c1-9-6-2-3-7(9)5-8(10)4-6/h6-7H,2-5H2,1H3/t6-,7+ | Synonyms: | TROPINONE | Definition date: | 2001-05-16 | Last modified: | 2020-06-17 | Identifier: | (1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-one |
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![TNG TNG](https://data.pdbj.org/pdbjplus/data/cc/svg/TNG.svg) | TNG | Name: | propane-1,2,3-triyl trinitrate | Formula: | C3 H5 N3 O9 | SMILES: | O=[N+]([O-])OC(CO[N+]([O-])=O)CO[N+](=O)[O-] | InChi: | InChI=1S/C3H5N3O9/c7-4(8)13-1-3(15-6(11)12)2-14-5(9)10/h3H,1-2H2 | Synonyms: | nitroglycerin | Definition date: | 2012-07-11 | Last modified: | 2020-06-17 | Release date: | 2012-09-21 | Identifier: | propane-1,2,3-triyl trinitrate |
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![TNH TNH](https://data.pdbj.org/pdbjplus/data/cc/svg/TNH.svg) | TNH | Name: | N-[6-(1,2,3,4-tetrahydroacridin-9-ylamino)hexyl]pyridine-3-carboxamide | Formula: | C25 H30 N4 O | SMILES: | O=C(NCCCCCCNc1c3ccccc3nc2c1CCCC2)c4cccnc4 | InChi: | InChI=1S/C25H30N4O/c30-25(19-10-9-15-26-18-19)28-17-8-2-1-7-16-27-24-20-11-3-5-13-22(20)29-23-14-6-4-12-21(23)24/h3,5,9-11,13,15,18H,1-2,4,6-8,12,14,16-17H2,(H,27,29)(H,28,30) | Synonyms: | 2-{2-[(1,2,3,4-tetrahydroacridin- 9-yl)amino]hexyl}N-nicotinamide | Definition date: | 2014-11-28 | Last modified: | 2020-06-17 | Release date: | 2015-12-23 | Identifier: | N-[6-(1,2,3,4-tetrahydroacridin-9-ylamino)hexyl]pyridine-3-carboxamide |
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![TNS TNS](https://data.pdbj.org/pdbjplus/data/cc/svg/TNS.svg) | TNS | Name: | N-(TRANS-4'-NITRO-4-STILBENYL)-N-METHYL-5-AMINO-PENTANOIC ACID | Formula: | C20 H22 N2 O4 | SMILES: | [O-][N+](=O)c1ccc(cc1)C=Cc2ccc(N(C)CCCCC(=O)O)cc2 | InChi: | InChI=1S/C20H22N2O4/c1-21(15-3-2-4-20(23)24)18-11-7-16(8-12-18)5-6-17-9-13-19(14-10-17)22(25)26/h5-14H,2-4,15H2,1H3,(H,23,24)/b6-5+ | Synonyms: | 5-[{4-[(E)-2-(4-NITROPHENYL)VINYL]PHENYL}(METHYL)AMINO]PENTANOIC ACID | Definition date: | 2006-02-20 | Last modified: | 2020-06-17 | Identifier: | 5-(methyl{4-[(E)-2-(4-nitrophenyl)ethenyl]phenyl}amino)pentanoic acid |
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![TO1 TO1](https://data.pdbj.org/pdbjplus/data/cc/svg/TO1.svg) | TO1 | Name: | 4-amino-7-(beta-D-ribofuranosyl)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile | Formula: | C12 H13 N5 O4 | SMILES: | N#Cc2c1c(ncnc1n(c2)C3OC(C(O)C3O)CO)N | InChi: | InChI=1S/C12H13N5O4/c13-1-5-2-17(11-7(5)10(14)15-4-16-11)12-9(20)8(19)6(3-18)21-12/h2,4,6,8-9,12,18-20H,3H2,(H2,14,15,16)/t6-,8-,9-,12-/m1/s1 | Synonyms: | TOYOCAMYCIN | Definition date: | 2011-04-22 | Last modified: | 2020-06-17 | Identifier: | 4-amino-7-(beta-D-ribofuranosyl)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile |
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![TO4 TO4](https://data.pdbj.org/pdbjplus/data/cc/svg/TO4.svg) | TO4 | Name: | propan-2-yl (R)-dodec-11-en-1-ylphosphonofluoridate | Formula: | C15 H30 F O2 P | SMILES: | P(CCCCCCCCCC[C@H]=C)(F)(=O)OC(C)C | InChi: | InChI=1S/C15H30FO2P/c1-4-5-6-7-8-9-10-11-12-13-14-19(16,17)18-15(2)3/h4,15H,1,5-14H2,2-3H3/t19-/m1/s1 | Synonyms: | 11-dodecenyl-phosphonofluoridic acid 1-methylethyl ester | Definition date: | 2020-03-25 | Last modified: | 2020-06-17 | Release date: | 2020-04-08 | Identifier: | propan-2-yl (R)-dodec-11-en-1-ylphosphonofluoridate |
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![B55 B55](https://data.pdbj.org/pdbjplus/data/cc/svg/B55.svg) | B55 | Name: | 2-amino-8-sulfanyl-1,9-dihydro-6H-purin-6-one | Formula: | C5 H5 N5 O S | SMILES: | O=C1c2nc(S)nc2N=C(N1)N | InChi: | InChI=1S/C5H5N5OS/c6-4-8-2-1(3(11)10-4)7-5(12)9-2/h(H5,6,7,8,9,10,11,12) | Synonyms: | 2-amino-8-mercapto-1H-purin-6(9H)-one | Definition date: | 2009-04-24 | Last modified: | 2020-06-17 | Identifier: | 2-amino-8-sulfanyl-1,9-dihydro-6H-purin-6-one |
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![TOG TOG](https://data.pdbj.org/pdbjplus/data/cc/svg/TOG.svg) | TOG | Name: | 4-[3-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-5-[2-[oxidanyl(phosphonooxy)phosphoryl]oxyethyl]-1,3-thiazol-3
-ium-2-yl]-4-oxidanyl-butanoic acid | Formula: | C16 H24 N4 O10 P2 S | SMILES: | Cc1ncc(C[n+]2c(C)c(CCO[P](O)(=O)O[P](O)(O)=O)sc2[C-](O)CCC(O)=O)c(N)n1 | InChi: | InChI=1S/C16H24N4O10P2S/c1-9-13(5-6-29-32(27,28)30-31(24,25)26)33-16(12(21)3-4-14(22)23)20(9)8-11-7-18-10(2)19-15(11)17/h7,21H,3-6,8H2,1-2H3,(H,22,23)(H,27,28)(H2,17,18,19)(H2,24,25,26) | Synonyms: | ThDP and decarboxylated 2-oxoglutarate adduct, covalent intermediate I, carboanion form | Definition date: | 2015-11-17 | Last modified: | 2020-06-17 | Release date: | 2016-06-22 | Identifier: | 4-[3-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-5-[2-[oxidanyl(phosphonooxy)phosphoryl]oxyethyl]-1,3-thiazol-3-ium-2-yl]-4-oxidanyl-butanoic acid |
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![TOI TOI](https://data.pdbj.org/pdbjplus/data/cc/svg/TOI.svg) | TOI | Name: | (1~{R},2~{S},5~{S},6~{S})-2-[(1~{S})-1-[3-[(4-azanylidene-2-methyl-1~{H}-pyrimidin-5-yl)methyl]-4-methyl-5-[2-[oxidanyl
(phosphonooxy)phosphoryl]oxyethyl]-1,3-thiazol-3-ium-2-yl]-1,4-bis(oxidanyl)-4-oxidanylidene-butyl]-6-oxidanyl-5-(3-oxid
anyl-3-oxidanylidene-prop-1-en-2-yl)oxy-cyclohex-3-ene-1-carboxylic acid | Formula: | C26 H35 N4 O16 P2 S | SMILES: | CC1=NC(=N)C(=CN1)C[n+]2c(C)c(CCO[P](O)(=O)O[P](O)(O)=O)sc2[C](O)(CCC(O)=O)[CH]3C=C[CH](OC(=C)C(O)=O)[CH](O)[CH]3C(O)=O | InChi: | InChI=1S/C26H34N4O16P2S/c1-12-18(7-9-44-48(42,43)46-47(39,40)41)49-25(30(12)11-15-10-28-14(3)29-22(15)27)26(38,8-6-19(31)32)16-4-5-17(45-13(2)23(34)35)21(33)20(16)24(36)37/h4-5,10,16-17,20-21,33,38H,2,6-9,11H2,1,3H3,(H7-,27,28,29,31,32,34,35,36,37,39,40,41,42,43)/p+1/t16-,17-,20+,21+,26-/m0/s1 | Synonyms: | ThDP, decarboxylated 2-oxoglutarate and isochorismate adduct, covalent intermediate II | Definition date: | 2015-11-17 | Last modified: | 2020-06-17 | Release date: | 2016-06-22 | Identifier: | (1~{R},2~{S},5~{S},6~{S})-2-[(1~{S})-1-[3-[(4-azanylidene-2-methyl-1~{H}-pyrimidin-5-yl)methyl]-4-methyl-5-[2-[oxidanyl(phosphonooxy)phosphoryl]oxyethyl]-1,3-thiazol-3-ium-2-yl]-1,4-bis(oxidanyl)-4-oxidanylidene-butyl]-6-oxidanyl-5-(3-oxidanyl-3-oxidanylidene-prop-1-en-2-yl)oxy-cyclohex-3-ene-1-carboxylic acid |
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![TP0 TP0](https://data.pdbj.org/pdbjplus/data/cc/svg/TP0.svg) | TP0 | Name: | Amitriptyline | Formula: | C20 H23 N | SMILES: | c3cc2c(/C(c1c(cccc1)CC2)=C/CCN(C)C)cc3 | InChi: | InChI=1S/C20H23N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-12H,7,13-15H2,1-2H3 | Synonyms: | 3-(10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-ylidene)-N,N-dimethylpropan-1-amine | Definition date: | 2010-11-09 | Last modified: | 2020-06-17 | Identifier: | 3-(10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-ylidene)-N,N-dimethylpropan-1-amine |
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![TP3 TP3](https://data.pdbj.org/pdbjplus/data/cc/svg/TP3.svg) | TP3 | Name: | 4-[[GLUTAMIC ACID]-CARBONYL]-BENZENE-SULFONYL-D-PROLINE | Formula: | C17 H20 N2 O9 S | SMILES: | O=C(O)C2N(S(=O)(=O)c1ccc(C(=O)NC(C(=O)O)CCC(=O)O)cc1)CCC2 | InChi: | InChI=1S/C17H20N2O9S/c20-14(21)8-7-12(16(23)24)18-15(22)10-3-5-11(6-4-10)29(27,28)19-9-1-2-13(19)17(25)26/h3-6,12-13H,1-2,7-9H2,(H,18,22)(H,20,21)(H,23,24)(H,25,26)/t12-,13+/m0/s1 | Synonyms: | SP-722 | Definition date: | 2000-06-13 | Last modified: | 2020-06-17 | Identifier: | N-[(4-{[(2R)-2-carboxypyrrolidin-1-yl]sulfonyl}phenyl)carbonyl]-L-glutamic acid |
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![TP4 TP4](https://data.pdbj.org/pdbjplus/data/cc/svg/TP4.svg) | TP4 | Name: | N-[4-[[GLUTAMIC ACID]-CARBONYL]-BENZENE-SULFONYL-D-PROLINYL]-3-AMINO-PROPANOIC ACID | Formula: | C20 H25 N3 O10 S | SMILES: | O=C(NCCC(=O)O)C2N(S(=O)(=O)c1ccc(C(=O)NC(C(=O)O)CCC(=O)O)cc1)CCC2 | InChi: | InChI=1S/C20H25N3O10S/c24-16(25)8-7-14(20(30)31)22-18(28)12-3-5-13(6-4-12)34(32,33)23-11-1-2-15(23)19(29)21-10-9-17(26)27/h3-6,14-15H,1-2,7-11H2,(H,21,29)(H,22,28)(H,24,25)(H,26,27)(H,30,31)/t14-,15+/m0/s1 | Synonyms: | SP-876 | Definition date: | 2000-06-13 | Last modified: | 2020-06-17 | Identifier: | 1-[(4-{[(1S)-1,3-dicarboxypropyl]carbamoyl}phenyl)sulfonyl]-D-prolyl-beta-alanine |
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![B64 B64](https://data.pdbj.org/pdbjplus/data/cc/svg/B64.svg) | B64 | Name: | 4-{[2-(methoxycarbonyl)-5-(2-thienyl)-3-thienyl]amino}-4-oxo-2-butenoic acid | Formula: | C14 H11 N O5 S2 | SMILES: | O=C(OC)c1sc(cc1NC(=O)/C=CC(=O)O)c2sccc2 | InChi: | InChI=1S/C14H11NO5S2/c1-20-14(19)13-8(15-11(16)4-5-12(17)18)7-10(22-13)9-3-2-6-21-9/h2-7H,1H3,(H,15,16)(H,17,18)/b5-4- | Synonyms: | (2Z)-4-{[5-(methoxycarbonyl)-2,2'-bithiophen-4-yl]amino}-4-oxobut-2-enoic acid | Definition date: | 2009-05-29 | Last modified: | 2020-06-17 | Identifier: | (2Z)-4-{[5-(methoxycarbonyl)-2,2'-bithiophen-4-yl]amino}-4-oxobut-2-enoic acid |
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![TP8 TP8](https://data.pdbj.org/pdbjplus/data/cc/svg/TP8.svg) | TP8 | Name: | 5-(2-{[HYDROXY(PHOSPHONOOXY)PHOSPHORYL]OXY}ETHYL)-2-[(1Z)-1-HYDROXY-3-(PHOSPHONOOXY)PROP-1-EN-1-YL]-3-{[(4Z)-4-IMINO-2-
METHYL-4,5-DIHYDROPYRIMIDIN-5-YL]METHYL}-4-METHYL-1,3-THIAZOL-3-IUM | Formula: | C15 H21 N4 O12 P3 S | SMILES: | CC1=NC(=N)[CH](C[n+]2c(C)c(CCO[P]([O-])(=O)O[P](O)([O-])=O)sc2C(O)=CCO[P](O)([O-])=O)C=N1 | InChi: | InChI=1S/C15H23N4O12P3S/c1-9-13(4-6-30-34(27,28)31-33(24,25)26)35-15(12(20)3-5-29-32(21,22)23)19(9)8-11-7-17-10(2)18-14(11)16/h3,7,11,16H,4-6,8H2,1-2H3,(H5-,20,21,22,23,24,25,26,27,28)/p-2/b12-3-,16-14+ | Synonyms: | PUTATIVE ENOL(ATE)-THDP REACTION INTERMEDIATE | Definition date: | 2006-10-13 | Last modified: | 2020-06-17 | Identifier: | [(Z)-3-hydroxy-3-[5-[2-[(hydroxy-oxido-phosphoryl)oxy-oxido-phosphoryl]oxyethyl]-3-[[(5S)-4-imino-2-methyl-5H-pyrimidin-5-yl]methyl]-4-methyl-1,3-thiazol-3-ium-2-yl]prop-2-enyl] hydrogen phosphate |
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![TPF TPF](https://data.pdbj.org/pdbjplus/data/cc/svg/TPF.svg) | TPF | Name: | 2-(2,4-DIFLUOROPHENYL)-1,3-DI(1H-1,2,4-TRIAZOL-1-YL)PROPAN-2-OL | Formula: | C13 H12 F2 N6 O | SMILES: | Fc1ccc(c(F)c1)C(O)(Cn2ncnc2)Cn3ncnc3 | InChi: | InChI=1S/C13H12F2N6O/c14-10-1-2-11(12(15)3-10)13(22,4-20-8-16-6-18-20)5-21-9-17-7-19-21/h1-3,6-9,22H,4-5H2 | Synonyms: | FLUCONAZOLE | Definition date: | 2000-11-03 | Last modified: | 2020-06-17 | Identifier: | 2-(2,4-difluorophenyl)-1,3-di-1H-1,2,4-triazol-1-ylpropan-2-ol |
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![TPW TPW](https://data.pdbj.org/pdbjplus/data/cc/svg/TPW.svg) | TPW | Name: | 2-{4-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-3-METHYLTHIOPHEN-2-YL}ETHYL TRIHYDROGEN DIPHOSPHATE | Formula: | C13 H19 N3 O7 P2 S | SMILES: | O=P(O)(O)OP(=O)(O)OCCc1scc(c1C)Cc2c(nc(nc2)C)N | InChi: | InChI=1S/C13H19N3O7P2S/c1-8-11(5-10-6-15-9(2)16-13(10)14)7-26-12(8)3-4-22-25(20,21)23-24(17,18)19/h6-7H,3-5H2,1-2H3,(H,20,21)(H2,14,15,16)(H2,17,18,19) | Synonyms: | 3-DEAZA-THDP | Definition date: | 2007-02-26 | Last modified: | 2020-06-17 | Identifier: | 2-{4-[(4-amino-2-methylpyrimidin-5-yl)methyl]-3-methylthiophen-2-yl}ethyl trihydrogen diphosphate |
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![TQ8 TQ8](https://data.pdbj.org/pdbjplus/data/cc/svg/TQ8.svg) | TQ8 | Name: | N-[(2S)-4-chloro-3-oxo-1-phenyl-butan-2-yl]-4-methyl-benzenesulfonamide | Formula: | C17 H18 Cl N O3 S | SMILES: | Cc1ccc(cc1)[S](=O)(=O)N[CH](Cc2ccccc2)C(=O)CCl | InChi: | InChI=1S/C17H18ClNO3S/c1-13-7-9-15(10-8-13)23(21,22)19-16(17(20)12-18)11-14-5-3-2-4-6-14/h2-10,16,19H,11-12H2,1H3/t16-/m0/s1 | Synonyms: | CAS329306 | Definition date: | 2010-11-17 | Last modified: | 2020-06-17 | Identifier: | N-[(2S)-4-chloro-3-oxo-1-phenyl-butan-2-yl]-4-methyl-benzenesulfonamide |
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![BLM BLM](https://data.pdbj.org/pdbjplus/data/cc/svg/BLM.svg) | BLM | Name: | BLEOMYCIN A2 | Formula: | C55 H85 N17 O21 S3 | SMILES: | O=C(N)C(N)CNC(c1nc(N)c(c(n1)C(=O)NC(C(=O)NC(C)C(O)C(C(=O)NC(C(=O)NCCc2nc(cs2)c3nc(C(=O)NCCCS(C)C)cs3)C(O)C)C)C(OC5OC(CO)C(O)C(O)C5OC4OC(CO)C(O)C(OC(=O)N)C4O)c6ncnc6)C)CC(=O)N | InChi: | InChI=1S/C55H85N17O21S3/c1-20-33(69-46(72-44(20)58)25(12-31(57)76)64-13-24(56)45(59)82)50(86)71-35(41(26-14-61-19-65-26)91-54-43(39(80)37(78)29(15-73)90-54)92-53-40(81)42(93-55(60)88)38(79)30(16-74)89-53)51(87)66-22(3)36(77)21(2)47(83)70-34(23(4)75)49(85)63-10-8-32-67-28(18-94-32)52-68-27(17-95-52)48(84)62-9-7-11-96(5)6/h14,17-19,21-25,29-30,34-43,53-54,64,73-75,77-81,96H,7-13,15-16,56H2,1-6H3,(H2,57,76)(H2,59,82)(H2,60,88)(H,61,65)(H,62,84)(H,63,85)(H,66,87)(H,70,83)(H,71,86)(H2,58,69,72)/t21-,22+,23+,24-,25-,29-,30+,34-,35-,36-,37+,38+,39-,40-,41-,42-,43-,53+,54-/m0/s1 | Synonyms: | N1-[3-(DIMETHYLSULFONIO)-PROPYL]BLEOMYCINAMIDE | Definition date: | 1999-12-01 | Last modified: | 2020-06-17 | Identifier: | (2R,3S,4S,5R,6R)-2-{[(2R,3S,4S,5S,6S)-2-{[(1R,2S)-2-[({6-amino-2-[(1S)-3-amino-1-{[(2S)-2,3-diamino-3-oxopropyl]amino}-3-oxopropyl]-5-methylpyrimidin-4-yl}carbonyl)amino]-3-{[(1R,2S,3S)-4-{[(1S,2R)-1-{[2-(4-{[3-(dimethyl-lambda~4~-sulfanyl)propyl]carbamoyl}-2,4'-bi-1,3-thiazol-2'-yl)ethyl]carbamoyl}-2-hydroxypropyl]amino}-2-hydroxy-1,3-dimethyl-4-oxobutyl]amino}-1-(1H-imidazol-4-yl)-3-oxopropyl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl carbamate (non-preferred name) |
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![TR5 TR5](https://data.pdbj.org/pdbjplus/data/cc/svg/TR5.svg) | TR5 | Name: | 5-methyl-1-(5-O-phosphono-beta-D-ribofuranosyl)-1,5-dihydro-1,4,5,6,8-pentaazaacenaphthylen-3-amine | Formula: | C13 H17 N6 O7 P | SMILES: | O=P(O)(O)OCC4OC(n1cc2C(=NN(c3ncnc1c23)C)N)C(O)C4O | InChi: | InChI=1S/C13H17N6O7P/c1-18-11-7-5(10(14)17-18)2-19(12(7)16-4-15-11)13-9(21)8(20)6(26-13)3-25-27(22,23)24/h2,4,6,8-9,13,20-21H,3H2,1H3,(H2,14,17)(H2,22,23,24)/t6-,8-,9-,13-/m1/s1 | Synonyms: | Triciribine phosphate | Definition date: | 2012-07-13 | Last modified: | 2020-06-17 | Release date: | 2012-12-28 | Identifier: | 5-methyl-1-(5-O-phosphono-beta-D-ribofuranosyl)-1,5-dihydro-1,4,5,6,8-pentaazaacenaphthylen-3-amine |
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![BLQ BLQ](https://data.pdbj.org/pdbjplus/data/cc/svg/BLQ.svg) | BLQ | Name: | (3E)-3-({4-[(2-carboxyethyl)carbamoyl]phenyl}hydrazono)-6-oxocyclohexa-1,4-diene-1-carboxylic acid | Formula: | C17 H15 N3 O6 | SMILES: | O=C2C=CC(=N/Nc1ccc(C(=O)NCCC(=O)O)cc1)C=C2C(=O)O | InChi: | InChI=1S/C17H15N3O6/c21-14-6-5-12(9-13(14)17(25)26)20-19-11-3-1-10(2-4-11)16(24)18-8-7-15(22)23/h1-6,9,19H,7-8H2,(H,18,24)(H,22,23)(H,25,26)/b20-12+ | Synonyms: | balsalazide | Definition date: | 2010-02-25 | Last modified: | 2020-06-17 | Identifier: | (3E)-3-(2-{4-[(2-carboxyethyl)carbamoyl]phenyl}hydrazinylidene)-6-oxocyclohexa-1,4-diene-1-carboxylic acid |
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![BLT BLT](https://data.pdbj.org/pdbjplus/data/cc/svg/BLT.svg) | BLT | Name: | 1,4-DIDEOXY-1,4-[[2R,3R)-2,4-DIHYDROXY-3-(SULFOXY)BUTYL]EPISELENONIUMYLIDENE]-D-ARABINITOL INNER SALT | Formula: | C9 H18 O9 S Se | SMILES: | [O-]S([O-])([O-])OC(CO)C(O)C[Se+]1C(CO)C(O)C(O)C1 | InChi: | InChI=1S/C9H20O9SSe/c10-1-7(18-19(15,16)17)5(12)3-20-4-6(13)9(14)8(20)2-11/h5-14H,1-4H2,(H2-,15,16,17)/p-2/t5-,6+,7+,8+,9-,20+/m0/s1 | Synonyms: | DIASTEREOMER OF SELENO-SALACINOL | Definition date: | 2004-06-22 | Last modified: | 2020-06-17 | Identifier: | ({[(1R,2R)-3-[(2R,3S,4S)-3,4-dihydroxy-2-(hydroxymethyl)tetrahydroselenophenium-1-yl]-2-hydroxy-1-(hydroxymethyl)propyl]oxy}-lambda~4~-sulfanetriyl)trioxidanide (non-preferred name) |
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![BM0 BM0](https://data.pdbj.org/pdbjplus/data/cc/svg/BM0.svg) | BM0 | Name: | 1-butyl-3-methyl-1H-imidazol-3-ium | Formula: | C8 H15 N2 | SMILES: | C(C)CCn1cc[n+](c1)C | InChi: | InChI=1S/C8H15N2/c1-3-4-5-10-7-6-9(2)8-10/h6-8H,3-5H2,1-2H3/q+1 | Synonyms: | 1-butyl-3-methylimidazolium | Definition date: | 2015-07-24 | Last modified: | 2020-06-17 | Release date: | 2015-11-04 | Identifier: | 1-butyl-3-methyl-1H-imidazol-3-ium |
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![TRD TRD](https://data.pdbj.org/pdbjplus/data/cc/svg/TRD.svg) | TRD | Name: | TRIDECANE | Formula: | C13 H28 | SMILES: | C(CCCCCCCC)CCCC | InChi: | InChI=1S/C13H28/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3-13H2,1-2H3 | Synonyms: | LIPID FRAGMENT | Definition date: | 1999-09-17 | Last modified: | 2020-06-17 | Identifier: | tridecane |
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