Chem
J-GLOBAL ID:200907050721348404   Nikkaji number:J1.999.234I

(5aR)-2-(Benzyloxy)-7,10bα-[[1-(tert-butoxycarbonyl)-1H-indole-4,3-diyl](oxazole-5,2-diyl)(2-methyloxazole-4,5-diyl)]-5aα,10b-dihydro-6H-benzofuro[2,3-b]indole

(5aR)-2-(ベンジルオキシ)-7,10bα-[[1-(tert-ブトキシカルボニル)-1H-インドール-4,3-ジイル](オキサゾール-5,2-ジイル)(2-メチルオキサゾール-4,5-ジイル)]-5aα,10b-ジヒドロ-6H-ベンゾフロ[2,3-b]インドール
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: C41H32N4O6
Molecular formula furigana: C41-H32-N4-O6
Molecular weight: 676.729
InChI: InChI=1S/C41H32N4O6/c1-22-43-35-36(48-22)41-28-14-8-13-26(34(28)44-38(41)50-31-17-16-24(18-29(31)41)47-21-23-10-6-5-7-11-23)25-12-9-15-30-33(25)27(32-19-42-37(35)49-32)20-45(30)39(46)51-40(2,3)4/h5-20,38,44H,21H2,1-4H3/t38-,41+/m1/s1
InChI key: WETQXFYXHYENAJ-UMBAWLCISA-N
SMILES: Cc1nc2c3ncc(o3)c3cn(C(=O)OC(C)(C)C)c4cccc(c5cccc6c5N[C@@H]5Oc7ccc(OCc8ccccc8)cc7[C@]65c2o1)c34
Systematic name  (3):
  • (5aR)-2-(ベンジルオキシ)-7,10bα-[[1-(tert-ブトキシカルボニル)-1H-インドール-4,3-ジイル](オキサゾール-5,2-ジイル)(2-メチルオキサゾール-4,5-ジイル)]-5aα,10b-ジヒドロ-6H-ベンゾフロ[2,3-b]インドール
  • tert-ブチル (11S,19R)-14-(ベンジルオキシ)-8-メチル-9,18,35-トリオキサ-4,7,20,32-テトラアザノナシクロ[25.6.1.12,5.06,10.011,19.011,22.012,17.021,26.031,34]ペンタトリアコンタ-1(33),2,4,6(10),7,12,14,16,21,23,25,27(34),28,30-テトラデカエン-32-カルボキシラート
  • tert-butyl (11S,19R)-14-(benzyloxy)-8-methyl-9,18,35-trioxa-4,7,20,32-tetraazanonacyclo[25.6.1.12,5.06,10.011,19.011,22.012,17.021,26.031,34]pentatriaconta-1(33),2,4,6(10),7,12,14,16,21,23,25,27(34),28,30-tetradecaene-32-carboxylate
Other name (1):
  • (5aR)-2-(Benzyloxy)-7,10bα-[[1-(tert-butoxycarbonyl)-1H-indole-4,3-diyl](oxazole-5,2-diyl)(2-methyloxazole-4,5-diyl)]-5aα,10b-dihydro-6H-benzofuro[2,3-b]indole
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