![BWU BWU](https://data.pdbj.org/pdbjplus/data/cc/svg/BWU.svg) | BWU | Name: | Tetraphenylporphycene contating cobalt | Formula: | C44 H28 Co N4 | SMILES: | [Co]1n2c3ccc2C(=C(c4ccccc4)C5=NC(=C6C=CC(=C(c7ccccc7)C(=C8C=CC3=N8)c9ccccc9)[N]16)C=C5)c%10ccccc%10 | InChi: | InChI=1S/C44H28N4.Co/c1-5-13-29(14-6-1)41-37-25-21-33(45-37)34-23-27-39(47-34)43(31-17-9-3-10-18-31)44(32-19-11-4-12-20-32)40-28-24-36(48-40)35-22-26-38(46-35)42(41)30-15-7-2-8-16-30 | Synonyms: | Co-9,10,19,20-Tetraphenylporphycene | Definition date: | 2019-03-25 | Last modified: | 2020-06-17 | Release date: | 2020-03-11 |
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![BWX BWX](https://data.pdbj.org/pdbjplus/data/cc/svg/BWX.svg) | BWX | Name: | (2S)-2-[[(2S)-2-[4-(2-methylpropyl)phenyl]propanoyl]amino]-3-phenyl-propanoic acid | Formula: | C22 H27 N O3 | SMILES: | CC(C)Cc1ccc(cc1)[CH](C)C(=O)N[CH](Cc2ccccc2)C(O)=O | InChi: | InChI=1S/C22H27NO3/c1-15(2)13-18-9-11-19(12-10-18)16(3)21(24)23-20(22(25)26)14-17-7-5-4-6-8-17/h4-12,15-16,20H,13-14H2,1-3H3,(H,23,24)(H,25,26)/t16-,20-/m0/s1 | Synonyms: | N-(S)-Ibuprofenoyl-L-Phenylalanine | Definition date: | 2019-03-26 | Last modified: | 2020-06-17 | Release date: | 2020-03-18 | Identifier: | (2~{S})-2-[[(2~{S})-2-[4-(2-methylpropyl)phenyl]propanoyl]amino]-3-phenyl-propanoic acid |
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![HBC HBC](https://data.pdbj.org/pdbjplus/data/cc/svg/HBC.svg) | HBC | Name: | (2-AMINO-3-PHENYL-BICYCLO[2.2.1]HEPT-2-YL)-PHENYL-METHANONE | Formula: | C20 H21 N O | SMILES: | O=C(c1ccccc1)C4(N)C2CCC(C2)C4c3ccccc3 | InChi: | InChI=1S/C20H21NO/c21-20(19(22)15-9-5-2-6-10-15)17-12-11-16(13-17)18(20)14-7-3-1-4-8-14/h1-10,16-18H,11-13,21H2/t16-,17+,18+,20+/m0/s1 | Synonyms: | BICYCLO[2.2.1]HEPTANE | Definition date: | 2001-08-06 | Last modified: | 2020-06-17 | Identifier: | [(1R,2R,3S,4S)-2-amino-3-phenylbicyclo[2.2.1]hept-2-yl](phenyl)methanone |
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![BX3 BX3](https://data.pdbj.org/pdbjplus/data/cc/svg/BX3.svg) | BX3 | Name: | (+)-2-[4-[(-1-ACETIMIDOYL-4-PIPERIDINYL)OXY]-3-(7-AMIDINO-2-NAPHTHYL)PROPIONIC ACID | Formula: | C27 H30 N4 O3 | SMILES: | O=C(O)C(c2ccc(OC1CCN(C(=[N@H])C)CC1)cc2)Cc4cc3cc(C(=[N@H])N)ccc3cc4 | InChi: | InChI=1S/C27H30N4O3/c1-17(28)31-12-10-24(11-13-31)34-23-8-6-20(7-9-23)25(27(32)33)15-18-2-3-19-4-5-21(26(29)30)16-22(19)14-18/h2-9,14,16,24-25,28H,10-13,15H2,1H3,(H3,29,30)(H,32,33)/b28-17+/t25-/m0/s1 | Synonyms: | BX5633 | Definition date: | 1999-07-08 | Last modified: | 2020-06-17 | Identifier: | (2S)-3-(7-carbamimidoylnaphthalen-2-yl)-2-[4-({1-[(1E)-ethanimidoyl]piperidin-4-yl}oxy)phenyl]propanoic acid |
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![HBM HBM](https://data.pdbj.org/pdbjplus/data/cc/svg/HBM.svg) | HBM | Name: | 2-(2,4-DICHLORO-PHENYL)-7-HYDROXY-1H-BENZOIMIDAZOLE-4-CARBOXYLIC ACID [2-(4-METHANESULFONYLAMINO-PHENYL)-ETHYL]-AMIDE | Formula: | C23 H20 Cl2 N4 O4 S | SMILES: | O=S(=O)(Nc1ccc(cc1)CCNC(=O)c2ccc(O)c3nc(nc23)c4ccc(Cl)cc4Cl)C | InChi: | InChI=1S/C23H20Cl2N4O4S/c1-34(32,33)29-15-5-2-13(3-6-15)10-11-26-23(31)17-8-9-19(30)21-20(17)27-22(28-21)16-7-4-14(24)12-18(16)25/h2-9,12,29-30H,10-11H2,1H3,(H,26,31)(H,27,28) | Synonyms: | 2-(2,4-DICHLOROPHENYL)-4-HYDROXY-N-(2-{4-[(METHYLSULFONYL)AMINO]PHENYL}ETHYL)-1H-BENZIMIDAZOLE-7-CARBOXAMIDE | Definition date: | 2006-12-14 | Last modified: | 2020-06-17 | Identifier: | 2-(2,4-dichlorophenyl)-4-hydroxy-N-(2-{4-[(methylsulfonyl)amino]phenyl}ethyl)-1H-benzimidazole-7-carboxamide |
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![HC2 HC2](https://data.pdbj.org/pdbjplus/data/cc/svg/HC2.svg) | HC2 | Name: | 20-HYDROXYCHOLESTEROL | Formula: | C27 H46 O2 | SMILES: | OC(C4C3(C(C1C(C2(C(=CC1)CC(O)CC2)C)CC3)CC4)C)(C)CCCC(C)C | InChi: | InChI=1S/C27H46O2/c1-18(2)7-6-14-27(5,29)24-11-10-22-21-9-8-19-17-20(28)12-15-25(19,3)23(21)13-16-26(22,24)4/h8,18,20-24,28-29H,6-7,9-17H2,1-5H3/t20-,21-,22-,23-,24-,25-,26-,27+/m0/s1 | Synonyms: | (3BETA,20R)-CHOLEST-5-ENE-3,20-DIOL | Definition date: | 2005-05-09 | Last modified: | 2020-06-17 | Identifier: | (3beta,14beta,17alpha,20R)-cholest-5-ene-3,20-diol |
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![HC3 HC3](https://data.pdbj.org/pdbjplus/data/cc/svg/HC3.svg) | HC3 | Name: | 25-HYDROXYCHOLESTEROL | Formula: | C27 H46 O2 | SMILES: | OC(C)(C)CCCC(C4C3(C(C1C(C2(C(=CC1)CC(O)CC2)C)CC3)CC4)C)C | InChi: | InChI=1S/C27H46O2/c1-18(7-6-14-25(2,3)29)22-10-11-23-21-9-8-19-17-20(28)12-15-26(19,4)24(21)13-16-27(22,23)5/h8,18,20-24,28-29H,6-7,9-17H2,1-5H3/t18-,20+,21+,22-,23+,24+,26+,27-/m1/s1 | Synonyms: | (3BETA)-CHOLEST-5-ENE-3,25-DIOL | Definition date: | 2005-05-10 | Last modified: | 2020-06-17 | Identifier: | (3beta,14beta,17alpha)-cholest-5-ene-3,25-diol |
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![HC7 HC7](https://data.pdbj.org/pdbjplus/data/cc/svg/HC7.svg) | HC7 | Name: | (2S)-2-[4'-({dimethyl[2-(phosphonooxy)ethyl]ammonio}acetyl)biphenyl-4-yl]-2-hydroxy-4,4-dimethylmorpholin-4-ium | Formula: | C24 H35 N2 O7 P | SMILES: | O=P(O)(O)OCC[N+](C)(C)CC(=O)c1ccc(cc1)c2ccc(cc2)C3(O)OCC[N+](C)(C)C3 | InChi: | InChI=1S/C24H33N2O7P/c1-25(2,14-16-33-34(29,30)31)17-23(27)21-7-5-19(6-8-21)20-9-11-22(12-10-20)24(28)18-26(3,4)13-15-32-24/h5-12,28H,13-18H2,1-4H3/p+2/t24-/m1/s1 | Synonyms: | 2-{4-[4-(2-{dimethyl[2-(phosphonatooxy)ethyl]azaniumyl}acetyl)phenyl]phenyl}-2-hydroxy-4,4-dimethylmorpholin-4-ium | Definition date: | 2008-12-04 | Last modified: | 2020-06-17 | Identifier: | (2S)-2-[4'-({dimethyl[2-(phosphonooxy)ethyl]ammonio}acetyl)biphenyl-4-yl]-2-hydroxy-4,4-dimethylmorpholin-4-ium |
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![HCV HCV](https://data.pdbj.org/pdbjplus/data/cc/svg/HCV.svg) | HCV | Name: | N-[(5S)-5-amino-5-carboxypentanoyl]-L-homocysteyl-D-valine | Formula: | C15 H27 N3 O6 S | SMILES: | O=C(NC(C(=O)O)C(C)C)C(NC(=O)CCCC(C(=O)O)N)CCS | InChi: | InChI=1S/C15H27N3O6S/c1-8(2)12(15(23)24)18-13(20)10(6-7-25)17-11(19)5-3-4-9(16)14(21)22/h8-10,12,25H,3-7,16H2,1-2H3,(H,17,19)(H,18,20)(H,21,22)(H,23,24)/t9-,10-,12+/m0/s1 | Synonyms: | Delta-L-alpha-aminoadipoyl-L-homocysteinyl-D-valine | Definition date: | 2013-01-24 | Last modified: | 2020-06-17 | Release date: | 2013-02-01 | Identifier: | N-[(5S)-5-amino-5-carboxypentanoyl]-L-homocysteyl-D-valine |
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![BYT BYT](https://data.pdbj.org/pdbjplus/data/cc/svg/BYT.svg) | BYT | Name: | Biocytin | Formula: | C16 H28 N4 O4 S | SMILES: | O=C1NC2C(SCC2N1)CCCCC(=O)NCCCCC(C(=O)O)N | InChi: | InChI=1S/C16H28N4O4S/c17-10(15(22)23)5-3-4-8-18-13(21)7-2-1-6-12-14-11(9-25-12)19-16(24)20-14/h10-12,14H,1-9,17H2,(H,18,21)(H,22,23)(H2,19,20,24)/t10-,11-,12-,14-/m0/s1 | Synonyms: | N~6~-{5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}-L-lysine | Definition date: | 2013-08-01 | Last modified: | 2020-06-17 | Release date: | 2014-09-10 | Identifier: | N~6~-{5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}-L-lysine |
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![BYY BYY](https://data.pdbj.org/pdbjplus/data/cc/svg/BYY.svg) | BYY | Name: | 5-[(3aS,4S,6aR)-2-oxohexahydro-1H-selenopheno[3,4-d]imidazol-4-yl]pentanoic acid | Formula: | C10 H16 N2 O3 Se | SMILES: | O=C1NC2C(N1)C([Se]C2)CCCCC(O)=O | InChi: | InChI=1S/C10H16N2O3Se/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m0/s1 | Synonyms: | selenobiotin | Definition date: | 2016-04-18 | Last modified: | 2020-06-17 | Release date: | 2016-11-16 | Identifier: | 5-[(3aS,4S,6aR)-2-oxohexahydro-1H-selenopheno[3,4-d]imidazol-4-yl]pentanoic acid |
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![HDD HDD](https://data.pdbj.org/pdbjplus/data/cc/svg/HDD.svg) | HDD | Name: | CIS-HEME D HYDROXYCHLORIN GAMMA-SPIROLACTONE | Formula: | C34 H32 Fe N4 O5 | SMILES: | O=C(O)CCc1c(c2C=C7C(=C(C=C)C6=Cc5c(c(C=C)c4C=C9N3C(=Cc1n2[Fe]3(n45)N67)C8(OC(=O)CC8)C9(O)C)C)C)C | InChi: | InChI=1S/C34H32N4O5.Fe/c1-7-20-17(3)23-13-24-19(5)22(9-10-31(39)40)28(37-24)16-30-34(12-11-32(41)43-34)33(6,42)29(38-30)15-27-21(8-2)18(4)25(36-27)14-26(20)35-23 | Synonyms: | HEME | Definition date: | 2000-08-22 | Last modified: | 2020-06-17 | Identifier: | {3-[(2R,5'S)-9',14'-diethenyl-5'-hydroxy-5',10',15',19'-tetramethyl-5-oxo-4,5-dihydro-3H-spiro[furan-2,4'-[21,22,23,24]tetraazapentacyclo[16.2.1.1~3,6~.1~8,11~.1~13,16~]tetracosa[1(20),2,6,8,10,12,14,16,18]nonaen]-20'-yl-kappa~4~N~21'~,N~22'~,N~23'~,N~24'~]propanoato(4-)}iron |
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![BZ7 BZ7](https://data.pdbj.org/pdbjplus/data/cc/svg/BZ7.svg) | BZ7 | Name: | N~1~-{2-[([1,1'-biphenyl]-3-carbonyl)amino]ethyl}-N~4~-tert-butyl-N~2~-(3-phenylpropanoyl)-L-aspartamide | Formula: | C32 H38 N4 O4 | SMILES: | N(C(CC(NC(C)(C)C)=O)C(=O)NCCNC(=O)c1cccc(c1)c2ccccc2)C(CCc3ccccc3)=O | InChi: | InChI=1S/C32H38N4O4/c1-32(2,3)36-29(38)22-27(35-28(37)18-17-23-11-6-4-7-12-23)31(40)34-20-19-33-30(39)26-16-10-15-25(21-26)24-13-8-5-9-14-24/h4-16,21,27H,17-20,22H2,1-3H3,(H,33,39)(H,34,40)(H,35,37)(H,36,38)/t27-/m0/s1 | Synonyms: | PKS21004 | Definition date: | 2017-09-05 | Last modified: | 2020-06-17 | Release date: | 2017-12-06 | Identifier: | N~1~-{2-[([1,1'-biphenyl]-3-carbonyl)amino]ethyl}-N~4~-tert-butyl-N~2~-(3-phenylpropanoyl)-L-aspartamide |
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![HDV HDV](https://data.pdbj.org/pdbjplus/data/cc/svg/HDV.svg) | HDV | Name: | 9-{2-deoxy-2-fluoro-5-O-[(R)-hydroxy{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-beta-D-arabinofuranosyl}-2-me
thyl-9H-purin-6-amine | Formula: | C11 H17 F N5 O12 P3 | SMILES: | O=P(OCC1OC(C(C1O)F)n3c2c(c(nc(n2)C)N)nc3)(O)OP(OP(O)(=O)O)(O)=O | InChi: | InChI=1S/C11H17FN5O12P3/c1-4-15-9(13)7-10(16-4)17(3-14-7)11-6(12)8(18)5(27-11)2-26-31(22,23)29-32(24,25)28-30(19,20)21/h3,5-6,8,11,18H,2H2,1H3,(H,22,23)(H,24,25)(H2,13,15,16)(H2,19,20,21)/t5-,6+,8-,11-/m1/s1 | Synonyms: | Clofarabine-TRIPHOSPHATE | Definition date: | 2018-06-27 | Last modified: | 2020-06-17 | Release date: | 2018-10-10 | Identifier: | 9-{2-deoxy-2-fluoro-5-O-[(R)-hydroxy{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-beta-D-arabinofuranosyl}-2-methyl-9H-purin-6-amine |
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![BZN BZN](https://data.pdbj.org/pdbjplus/data/cc/svg/BZN.svg) | BZN | Name: | N-({(3R,4R)-4-[(benzyloxy)methyl]pyrrolidin-3-yl}methyl)-N-(2-methylpropyl)benzenesulfonamide | Formula: | C23 H32 N2 O3 S | SMILES: | O=S(=O)(c1ccccc1)N(CC(C)C)CC3CNCC3COCc2ccccc2 | InChi: | InChI=1S/C23H32N2O3S/c1-19(2)15-25(29(26,27)23-11-7-4-8-12-23)16-21-13-24-14-22(21)18-28-17-20-9-5-3-6-10-20/h3-12,19,21-22,24H,13-18H2,1-2H3/t21-,22-/m1/s1 | Synonyms: | N-((3R,4R)-4-Benzyloxymethyl-pyrrolidin-3-ylmethyl)-N-isobutyl-benzene sulfonamide | Definition date: | 2007-12-05 | Last modified: | 2020-06-17 | Identifier: | N-({(3R,4R)-4-[(benzyloxy)methyl]pyrrolidin-3-yl}methyl)-N-(2-methylpropyl)benzenesulfonamide |
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![BZQ BZQ](https://data.pdbj.org/pdbjplus/data/cc/svg/BZQ.svg) | BZQ | Name: | DIPHENYLMETHANONE | Formula: | C13 H10 O | SMILES: | O=C(c1ccccc1)c2ccccc2 | InChi: | InChI=1S/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H | Synonyms: | BENZENE, BENZOYL- | Definition date: | 2000-03-08 | Last modified: | 2020-06-17 | Identifier: | diphenylmethanone |
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![HE5 HE5](https://data.pdbj.org/pdbjplus/data/cc/svg/HE5.svg) | HE5 | Name: | ZINC(II)-DEUTEROPORPHYRIN DIMETHYLESTER | Formula: | C32 H34 N4 O4 Zn | SMILES: | COC(=O)CCc1c(C)c2C=C3C[CH](C)C4=Cc5cc(C)c6C=C7N8C(=Cc1n2[Zn]8(N34)n56)C(=C7C)CCC(=O)OC | InChi: | InChI=1S/C32H34N4O4.Zn/c1-17-11-22-14-27-19(3)23(7-9-31(37)39-5)29(35-27)16-30-24(8-10-32(38)40-6)20(4)28(36-30)15-26-18(2)12-21(34-26)13-25(17)33-22 | Synonyms: | ZND-DME | Definition date: | 2006-10-10 | Last modified: | 2020-06-17 |
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![HE7 HE7](https://data.pdbj.org/pdbjplus/data/cc/svg/HE7.svg) | HE7 | Name: | 4-{[(14beta,17alpha)-3-hydroxyestra-1,3,5(10)-trien-17-yl]oxy}-4-oxobutanoic acid | Formula: | C22 H28 O5 | SMILES: | O=C(O)CCC(=O)OC4CCC3C2C(c1ccc(O)cc1CC2)CCC34C | InChi: | InChI=1S/C22H28O5/c1-22-11-10-16-15-5-3-14(23)12-13(15)2-4-17(16)18(22)6-7-19(22)27-21(26)9-8-20(24)25/h3,5,12,16-19,23H,2,4,6-11H2,1H3,(H,24,25)/t16-,17-,18+,19+,22+/m1/s1 | Synonyms: | 1,3,5(10)-Estratrien-3-[(17beta)-diol]-17-hemisuccinate | Definition date: | 2007-09-06 | Last modified: | 2020-06-17 | Identifier: | 4-{[(14beta,17alpha)-3-hydroxyestra-1,3,5(10)-trien-17-yl]oxy}-4-oxobutanoic acid |
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![C01 C01](https://data.pdbj.org/pdbjplus/data/cc/svg/C01.svg) | C01 | Name: | (2S)-(4-ISOPROPYLPHENYL)[(2-METHYL-3-OXO-5,7-DIPROPYL-2,3-DIHYDRO-1,2-BENZISOXAZOL-6-YL)OXY]ACETATE | Formula: | C25 H30 N O5 | SMILES: | [O-]C(=O)C(Oc2c(cc1c(ON(C1=O)C)c2CCC)CCC)c3ccc(cc3)C(C)C | InChi: | InChI=1S/C25H31NO5/c1-6-8-18-14-20-23(31-26(5)24(20)27)19(9-7-2)21(18)30-22(25(28)29)17-12-10-16(11-13-17)15(3)4/h10-15,22H,6-9H2,1-5H3,(H,28,29)/p-1/t22-/m0/s1 | Synonyms: | ALPHA-ARYLOXYPHENYLACETIC ACID AGONIST | Definition date: | 2005-04-26 | Last modified: | 2020-06-17 | Identifier: | (2S)-[4-(1-methylethyl)phenyl][(2-methyl-3-oxo-5,7-dipropyl-2,3-dihydro-1,2-benzisoxazol-6-yl)oxy]ethanoate |
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![C09 C09](https://data.pdbj.org/pdbjplus/data/cc/svg/C09.svg) | C09 | Name: | 2-(ethoxymethyl)-1H-imidazo[4,5-c]quinolin-4-amine | Formula: | C13 H14 N4 O | SMILES: | n3c1ccccc1c2c(nc(n2)COCC)c3N | InChi: | InChI=1S/C13H14N4O/c1-2-18-7-10-16-11-8-5-3-4-6-9(8)15-13(14)12(11)17-10/h3-6H,2,7H2,1H3,(H2,14,15)(H,16,17) | Synonyms: | CL097 | Definition date: | 2013-01-22 | Last modified: | 2020-06-17 | Release date: | 2013-04-03 | Identifier: | 2-(ethoxymethyl)-1H-imidazo[4,5-c]quinolin-4-amine |
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![HEM HEM](https://data.pdbj.org/pdbjplus/data/cc/svg/HEM.svg) | HEM | Name: | PROTOPORPHYRIN IX CONTAINING FE | Formula: | C34 H32 Fe N4 O4 | SMILES: | C=1c3c(c(c4C=C5C(=C(C=6C=C7C(=C(C8=CC=2C(=C(C=1N=2[Fe](n34)(N5=6)N78)CCC(=O)O)C)C=C)C)C=C)C)C)CCC(=O)O | InChi: | InChI=1S/C34H34N4O4.Fe/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25 | Synonyms: | HEME | Definition date: | 1999-07-08 | Last modified: | 2020-06-17 | Identifier: | 3-[(5Z,10Z,14Z,19Z)-18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17-tetramethyl-21,23-dihydroporphyrin-2-yl]propanoic acid |
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![C0L C0L](https://data.pdbj.org/pdbjplus/data/cc/svg/C0L.svg) | C0L | Name: | methyl
[(1E,5R)-5-{(3E)-3-[(2E,4E,8R,9E,12E)-1,8-dihydroxy-2,5,9-trimethyltetradeca-2,4,9,12-tetraen-1-ylidene]-2,4-dioxo-3,4-d
ihydro-2H-pyran-6-yl}hex-1-en-1-yl]carbamate | Formula: | C30 H41 N O7 | SMILES: | CC=[C@H]CC=C(/C)C(O)CCC(=[C@H]C=C(/C)C(O)=C1C(=O)C=C(OC1=O)C(CC[C@H]=CNC(=O)OC)C)C | InChi: | InChI=1S/C30H41NO7/c1-7-8-9-12-21(3)24(32)17-15-20(2)14-16-23(5)28(34)27-25(33)19-26(38-29(27)35)22(4)13-10-11-18-31-30(36)37-6/h7-8,11-12,14,16,18-19,22,24,32,34H,9-10,13,15,17H2,1-6H3,(H,31,36)/b8-7+,18-11+,20-14+,21-12+,23-16+,28-27?/t22-,24-/m1/s1 | Synonyms: | Corallopyronin A | Definition date: | 2018-08-14 | Last modified: | 2020-06-17 | Release date: | 2018-11-21 | Identifier: | methyl [(1E,5R)-5-{(3E)-3-[(2E,4E,8R,9E,12E)-1,8-dihydroxy-2,5,9-trimethyltetradeca-2,4,9,12-tetraen-1-ylidene]-2,4-dioxo-3,4-dihydro-2H-pyran-6-yl}hex-1-en-1-yl]carbamate |
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![HFD HFD](https://data.pdbj.org/pdbjplus/data/cc/svg/HFD.svg) | HFD | Name: | 2-fluoro-9-{5-O-[(R)-hydroxy{[(R)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-beta-D-arabinofuranosyl}-9H-purin-6-a
mine | Formula: | C10 H15 F N5 O13 P3 | SMILES: | O=P(OCC1OC(C(C1O)O)n3c2c(c(nc(n2)F)N)nc3)(O)OP(OP(O)(O)=O)(O)=O | InChi: | InChI=1S/C10H15FN5O13P3/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-6(18)5(17)3(27-9)1-26-31(22,23)29-32(24,25)28-30(19,20)21/h2-3,5-6,9,17-18H,1H2,(H,22,23)(H,24,25)(H2,12,14,15)(H2,19,20,21)/t3-,5-,6+,9-/m1/s1 | Synonyms: | Fludarabine-TRIPHOSPHATE | Definition date: | 2018-06-27 | Last modified: | 2020-06-17 | Release date: | 2018-10-10 | Identifier: | 2-fluoro-9-{5-O-[(R)-hydroxy{[(R)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-beta-D-arabinofuranosyl}-9H-purin-6-amine |
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![C1A C1A](https://data.pdbj.org/pdbjplus/data/cc/svg/C1A.svg) | C1A | Name: | (2,5-dimethylbenzene-1,4-diyl)dimethanediyl bis(N-carbamimidoylcarbamimidothioate) | Formula: | C14 H22 N8 S2 | SMILES: | S(C(=[N@H])NC(=[N@H])N)Cc1cc(c(cc1C)CSC(=[N@H])NC(=[N@H])N)C | InChi: | InChI=1S/C14H22N8S2/c1-7-3-10(6-24-14(20)22-12(17)18)8(2)4-9(7)5-23-13(19)21-11(15)16/h3-4H,5-6H2,1-2H3,(H5,15,16,19,21)(H5,17,18,20,22) | Synonyms: | 4-({[(E)-{[(E)-AMINO(IMINO)METHYL]AMINO}(IMINO)METHYL]SULFANYL}METHYL)-2,5-DIMETHYLBENZYL
N-[(E)-AMINO(IMINO)METHYL]IMIDOTHIOCARBAMATE | Definition date: | 2005-08-31 | Last modified: | 2020-06-17 | Identifier: | (2,5-dimethylbenzene-1,4-diyl)dimethanediyl bis(N-carbamimidoylcarbamimidothioate) |
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![C1C C1C](https://data.pdbj.org/pdbjplus/data/cc/svg/C1C.svg) | C1C | Name: | 1,1'-binaphthalene-2,2'-dicarboxylic acid | Formula: | C22 H14 O4 | SMILES: | O=C(O)c4ccc1c(cccc1)c4c2c3c(ccc2C(=O)O)cccc3 | InChi: | InChI=1S/C22H14O4/c23-21(24)17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)22(25)26/h1-12H,(H,23,24)(H,25,26) | Synonyms: | 1-(2-carboxynaphth-1yl)-2-naphthoic acid | Definition date: | 2010-04-19 | Last modified: | 2020-06-17 | Identifier: | 1,1'-binaphthalene-2,2'-dicarboxylic acid |
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