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Clinical data |
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Other names | (2Z,4S,4aS,5aS,6S,12aS)-7-chloro-4-dimethylamino-6,10,11,12a-tetrahydroxy-2--6-methyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione |
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Identifiers |
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IUPAC name
- (4S,4aS,5aS,6S,12aR)-7-Chloro-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-N-(hydroxymethyl)-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide
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CAS Number | |
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ChEMBL | |
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CompTox Dashboard (EPA) | |
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Chemical and physical data |
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Formula | C23H25ClN2O9 |
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Molar mass | 508.91 g·mol |
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3D model (JSmol) | |
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SMILES
- Clc1c4c(c(O)cc1)C(\O)=C3\C(=O)2(O)C(=O)/C(C(=O)(N(C)C)2C34(O)C)=C(\O)NCO
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InChI
- InChI=1S/C23H25ClN2O9/c1-22(34)8-6-9-16(26(2)3)18(30)14(21(33)25-7-27)20(32)23(9,35)19(31)12(8)17(29)13-11(28)5-4-10(24)15(13)22/h4-5,8-9,16,27-28,30-31,34-35H,6-7H2,1-3H3,(H,25,33)/t8?,9-,16-,22-,23-/m0/s1
- Key:GJGDLRSSCNAKGL-BJNNJSPUSA-N
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