Chem
J-GLOBAL ID：200907010879695975
Nikkaji number：J927.442A
(2E,5S,5′S)-1,1′-Dipropionyl-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′-ジプロピオニル-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： C38H32N4O8
Molecular formula furigana： C38-H32-N4-O8
Molecular weight： 672.694
InChI：
InChI=1S/C38H32N4O8/c1-5-25(43)27-29(35(45)41-23(37(47)49-3)15-19-17-11-7-9-13-21(17)39-31(19)33(27)41)30-28(26(44)6-2)34-32-20(18-12-8-10-14-22(18)40-32)16-24(38(48)50-4)42(34)36(30)46/h7-14,23-24,39-40H,5-6,15-16H2,1-4H3/b30-29+/t23-,24-/m0/s1
InChI key：
OYLMSBAQJANIFR-FSODFTAHSA-N
SMILES：
CCC(=O)C1=C2N([C@@H](Cc3c2[nH]c2ccccc32)C(=O)OC)C(=O)/C/1=C\1/C(=O)N2[C@@H](Cc3c([nH]c4ccccc34)C2=C1C(=O)CC)C(=O)OC
Systematic name (3)：
- (2E,5S,5′S)-1,1′-ジプロピオニル-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)-2-[(2E,5S)-5-(メトキシカルボニル)-3-オキソ-1-プロパノイル-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-1-プロパノイル-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)-2-[(2E,5S)-5-(methoxycarbonyl)-3-oxo-1-propanoyl-2H,3H,5H,6H,11H-indolo[3,2-g]indolizin-2-ylidene]-3-oxo-1-propanoyl-2H,3H,5H,6H,11H-indolo[3,2-g]indolizine-5-carboxylate
- (2E,5S,5′S)-1,1′-Dipropionyl-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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