Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L6IV2E
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| Ligand Name |
2-(1-Dimethylaminomethyl-2-hydroxy-8-hydroxymethyl-9-oxo-9,11-dihydro-indolizino[1,2-B]quinolin-7-YL)-2-hydroxy-butyric acid
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| Synonyms |
Hydrotopotecan; 132877-29-3; Topotecancarboxylic acid; Topotecan acid sodium salt; SKF 105992; V2Q5PG98DR; (2S)-2-[1-[(dimethylamino)methyl]-2-hydroxy-8-(hydroxymethyl)-9-oxo-11H-indolizino[1,2-b]quinolin-7-yl]-2-hydroxybutanoic acid; 2-(1-DIMETHYLAMINOMETHYL-2-HYDROXY-8-HYDROXYMETHYL-9-OXO-9,11-DIHYDRO-INDOLIZINO[1,2-B]QUINOLIN-7-YL)-2-HYDROXY-BUTYRIC ACID; TTG; UNII-V2Q5PG98DR; SCHEMBL9971289; DTXSID20157828; ZINC22067027; ZINC35653234; SKF-105992; Q27466745; (alphaS)-alpha-Hydroxy-8-oxylato-1(11H)-oxo-alpha-ethyl-2-(hydroxymethyl)-9-(dimethylaminiomethyl)-5,11a-diaza-11aH-benzo[b]fluorene-3-acetic acid anion; INDOLIZINO(1,2-B)QUINOLINE-7-ACETIC ACID, 1-((DIMETHYLAMINO)METHYL)-.ALPHA.-ETHYL-9,11-DIHYDRO-.ALPHA.,2-DIHYDROXY-8-(HYDROXYMETHYL)-9-OXO-, (.ALPHA.S)-
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| Structure |
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Download2D MOL |
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| Formula |
C23H25N3O6
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| Canonical SMILES |
CCC(C1=C(C(=O)N2CC3=CC4=C(C=CC(=C4CN(C)C)O)N=C3C2=C1)CO)(C(=O)O)O
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| InChI |
1S/C23H25N3O6/c1-4-23(32,22(30)31)16-8-18-20-12(9-26(18)21(29)15(16)11-27)7-13-14(10-25(2)3)19(28)6-5-17(13)24-20/h5-8,27-28,32H,4,9-11H2,1-3H3,(H,30,31)/t23-/m0/s1
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| InChIKey |
DPQJTQJZJNYUEC-QHCPKHFHSA-N
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| PubChem Compound ID | ||||
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