Chem
J-GLOBAL ID：200907009395436845
Nikkaji number：J927.441C
(2E,5S,5′S)-1,1′-Diacetyl-6,6′,11,11′-tetrahydro-3,3′-dioxo-Δ2,2′(5H,5′H)-bi[3H-indolizino[8,7-b]indole]-5,5′-dicarboxylic acid dimethyl ester
(2E,5S,5′S)-1,1′-ジアセチル-6,6′,11,11′-テトラヒドロ-3,3′-ジオキソ-Δ2,2′(5H,5′H)-ビ[3H-インドリジノ[8,7-b]インドール]-5,5′-ジカルボン酸ジメチル
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
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
Molecular formula： C36H28N4O8
Molecular formula furigana： C36-H28-N4-O8
Molecular weight： 644.640
InChI：
InChI=1S/C36H28N4O8/c1-15(41)25-27(33(43)39-23(35(45)47-3)13-19-17-9-5-7-11-21(17)37-29(19)31(25)39)28-26(16(2)42)32-30-20(18-10-6-8-12-22(18)38-30)14-24(36(46)48-4)40(32)34(28)44/h5-12,23-24,37-38H,13-14H2,1-4H3/b28-27+/t23-,24-/m0/s1
InChI key：
DAHNORRAAGJVSG-IFKSUAARSA-N
SMILES：
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)C2=C(C(=O)C)/C(=C/3\C(=O)N4[C@@H](Cc5c([nH]c6ccccc56)C4=C3C(=O)C)C(=O)OC)/C(=O)N12
Systematic name (3)：
- (2E,5S,5′S)-1,1′-ジアセチル-6,6′,11,11′-テトラヒドロ-3,3′-ジオキソ-Δ2,2′(5H,5′H)-ビ[3H-インドリジノ[8,7-b]インドール]-5,5′-ジカルボン酸ジメチル
- メチル (5S)-1-アセチル-2-[(2E,5S)-1-アセチル-5-(メトキシカルボニル)-3-オキソ-2H,3H,5H,6H,11H-インドロ[3,2-g]インドリジン-2-イリデン]-3-オキソ-2H,3H,5H,6H,11H-インドロ[3,2-g]インドリジン-5-カルボキシラート
- methyl (5S)-1-acetyl-2-[(2E,5S)-1-acetyl-5-(methoxycarbonyl)-3-oxo-2H,3H,5H,6H,11H-indolo[3,2-g]indolizin-2-ylidene]-3-oxo-2H,3H,5H,6H,11H-indolo[3,2-g]indolizine-5-carboxylate
- (2E,5S,5′S)-1,1′-Diacetyl-6,6′,11,11′-tetrahydro-3,3′-dioxo-Δ2,2′(5H,5′H)-bi[3H-indolizino[8,7-b]indole]-5,5′-dicarboxylic acid dimethyl ester
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