Chem
J-GLOBAL ID：200907017325212152   Nikkaji number：J1.208.693H

(5aR)-3-[[2-(1,1-Dimethyl-2-propenyl)-1H-indole-3-yl]methylene]-7-(3-methyl-2-butenyl)-2,3,4,5aα,6,10b,11,11aα-octahydro-10bα-hydroxy-1H-pyrazino[1′,2′:1,5]pyrrolo[2,3-b]indole-1,4-dione

(5aR)-3-[[2-(1,1-ジメチル-2-プロペニル)-1H-インドール-3-イル]メチレン]-7-(3-メチル-2-ブテニル)-2,3,4,5aα,6,10b,11,11aα-オクタヒドロ-10bα-ヒドロキシ-1H-ピラジノ[1′,2′:1,5]ピロロ[2,3-b]インドール-1,4-ジオン
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： C32H34N4O3
Molecular formula furigana： C32-H34-N4-O3
Molecular weight： 522.649
InChI： InChI=1S/C32H34N4O3/c1-6-31(4,5)27-21(20-11-7-8-13-23(20)33-27)16-24-29(38)36-25(28(37)34-24)17-32(39)22-12-9-10-19(15-14-18(2)3)26(22)35-30(32)36/h6-14,16,25,30,33,35,39H,1,15,17H2,2-5H3,(H,34,37)/t25-,30+,32-/m0/s1
InChI key： JSBSVMCRQHPARV-RMRIFHTGSA-N
SMILES： CC(=CCc1cccc2c1N[C@@H]1N3[C@@H](C[C@]21O)C(=O)NC(=Cc1c([nH]c2ccccc12)C(C)(C)C=C)C3=O)C
Systematic name  (3)：
  • (5aR)-3-[[2-(1,1-ジメチル-2-プロペニル)-1H-インドール-3-イル]メチレン]-7-(3-メチル-2-ブテニル)-2,3,4,5aα,6,10b,11,11aα-オクタヒドロ-10bα-ヒドロキシ-1H-ピラジノ[1′,2′:1,5]ピロロ[2,3-b]インドール-1,4-ジオン
  • (1R,7S,9S)-9-ヒドロキシ-14-(3-メチルブタ-2-エン-1-イル)-4-{[2-(2-メチルブタ-3-エン-2-イル)-1H-インドール-3-イル]メチリデン}-2,5,16-トリアザテトラシクロ[7.7.0.02,7.010,15]ヘキサデカ-10(15),11,13-トリエン-3,6-ジオン
  • (1R,7S,9S)-9-hydroxy-14-(3-methylbut-2-en-1-yl)-4-{[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]methylidene}-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10(15),11,13-triene-3,6-dione
Other name (1)：
  • (5aR)-3-[[2-(1,1-Dimethyl-2-propenyl)-1H-indole-3-yl]methylene]-7-(3-methyl-2-butenyl)-2,3,4,5aα,6,10b,11,11aα-octahydro-10bα-hydroxy-1H-pyrazino[1′,2′:1,5]pyrrolo[2,3-b]indole-1,4-dione
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