Chem
J-GLOBAL ID：200907069449068602
Nikkaji number：J2.176.834K
(3aS)-2,8-Dibenzyl-6β,10β-etheno-1,2,3,3aα,4,6,6aα,7,8,9,9aα,10,10aα,10bα-tetradecahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
(3aS)-2,8-ジベンジル-6β,10β-エテノ-1,2,3,3aα,4,6,6aα,7,8,9,9aα,10,10aα,10bα-テトラデカヒドロイソインドロ[5,6-e]イソインドール-1,3,7,9-テトラオン
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： C30H26N2O4
Molecular formula furigana： C30-H26-N2-O4
Molecular weight： 478.548
InChI：
InChI=1S/C30H26N2O4/c33-27-22-14-12-19-20-11-13-21(23(19)26(22)30(36)31(27)15-17-7-3-1-4-8-17)25-24(20)28(34)32(29(25)35)16-18-9-5-2-6-10-18/h1-13,20-26H,14-16H2/t20-,21+,22+,23+,24-,25+,26+/m1/s1
InChI key：
MDUYYSZYCHONDG-DAEGYCLPSA-N
SMILES：
O=C1[C@H]2CC=C3[C@H]4C=C[C@H]([C@H]5[C@@H]4C(=O)N(Cc4ccccc4)C5=O)[C@H]3[C@H]2C(=O)N1Cc1ccccc1
Systematic name (3)：
- (3aS)-2,8-ジベンジル-6β,10β-エテノ-1,2,3,3aα,4,6,6aα,7,8,9,9aα,10,10aα,10bα-テトラデカヒドロイソインドロ[5,6-e]イソインドール-1,3,7,9-テトラオン
- (1S,2S,3R,7S,11S,12R,16S)-5,14-ジベンジル-5,14-ジアザペンタシクロ[9.5.2.02,10.03,7.012,16]オクタデカ-9,17-ジエン-4,6,13,15-テトラオン
- (1S,2S,3R,7S,11S,12R,16S)-5,14-dibenzyl-5,14-diazapentacyclo[9.5.2.02,10.03,7.012,16]octadeca-9,17-diene-4,6,13,15-tetrone
- (3aS)-2,8-Dibenzyl-6β,10β-etheno-1,2,3,3aα,4,6,6aα,7,8,9,9aα,10,10aα,10bα-tetradecahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
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