Chem
J-GLOBAL ID:200907053963936776
Nikkaji number:J364.124D
SKF-105992
SKF-105992
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C23 H25 N3 O6
Molecular formula furigana:
C23-H25-N3-O6
Molecular weight:
439.468
InChI:
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
InChI key:
DPQJTQJZJNYUEC-QHCPKHFHSA-N
SMILES:
CC[C@@](O)(C(=O)O)c1cc2c3nc4ccc(O)c(CN(C)C)c4cc3Cn2c(=O)c1CO
Systematic name (5):
(αS)-α-エチル-α,2-ジヒドロキシ-1-(ジメチルアミノメチル)-8-(ヒドロキシメチル)-9-オキソ-9,11-ジヒドロインドリジノ[1,2-b]キノリン-7-酢酸
(2S)-2-[[2-ヒドロキシ-8-ヒドロキシメチル-1-[(ジメチルアミノ)メチル]-9-オキソ-9,11-ジヒドロインドリジノ[1,2-b]キノリン]-7-イル]-2-ヒドロキシブタン酸
(αS)-α-エチル-9,11-ジヒドロ-2,α-ジヒドロキシ-1-ジメチルアミノメチル-8-ヒドロキシメチル-9-オキソインドリジノ[1,2-b]キノリン-7-酢酸
(2S)-2-{1-[(ジメチルアミノ)メチル]-2-ヒドロキシ-8-(ヒドロキシメチル)-9-オキソ-9H,11H-インドリジノ[1,2-b]キノリン-7-イル}-2-ヒドロキシブタン酸
(2S)-2-{1-[(dimethylamino)methyl]-2-hydroxy-8-(hydroxymethyl)-9-oxo-9H,11H-indolizino[1,2-b]quinolin-7-yl}-2-hydroxybutanoic acid
Other name (4):
SKF-105992
(αS)-α-Ethyl-9,11-dihydro-2,α-dihydroxy-1-dimethylaminomethyl-8-hydroxymethyl-9-oxoindolizino[1,2-b]quinoline-7-acetic acid
トポテカンヒドロキシ酸
Topotecan hydroxy acid
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