Chem
J-GLOBAL ID:200907034435919628
Nikkaji number:J927.446D
(2E,5S,5′S)-1,1′-Bis(4-methoxybenzoyl)-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′-ビス(4-メトキシベンゾイル)-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
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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:
C48 H36 N4 O10
Molecular formula furigana:
C48-H36-N4-O10
Molecular weight:
828.834
InChI:
InChI=1S/C48H36N4O10/c1-59-25-17-13-23(14-18-25)43(53)37-35(45(55)51-33(47(57)61-3)21-29-27-9-5-7-11-31(27)49-39(29)41(37)51)36-38(44(54)24-15-19-26(60-2)20-16-24)42-40-30(28-10-6-8-12-32(28)50-40)22-34(48(58)62-4)52(42)46(36)56/h5-20,33-34,49-50H,21-22H2,1-4H3/b36-35+/t33-,34-/m0/s1
InChI key:
YXPJMEQCSCFMGF-BRLFHZAYSA-N
SMILES:
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)C2=C(C(=O)c3ccc(OC)cc3)/C(=C/3\C(=O)N4[C@@H](Cc5c([nH]c6ccccc56)C4=C3C(=O)c3ccc(OC)cc3)C(=O)OC)/C(=O)N12
Systematic name (3):
(2E,5S,5′S)-1,1′-ビス(4-メトキシベンゾイル)-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-(4-メトキシベンゾイル)-2-[(2E,5S)-1-(4-メトキシベンゾイル)-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-(4-methoxybenzoyl)-2-[(2E,5S)-1-(4-methoxybenzoyl)-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
Other name (1):
(2E,5S,5′S)-1,1′-Bis(4-methoxybenzoyl)-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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