Chemical Compound

(1R,2S,4R,9S,12S)-1-Methyl-2,4,6-tris(3-methyl-2-butenyl)-9-(1-hydroxy-1-methylethyl)-12-(2-methyl-1-oxopropyl)-4,12-methano-8-oxabicyclo[5.4.1]dodecane-6-ene-5,13-dione

(1R,2S,4R,9S,12S)-1-Methyl-2,4,6-tris(3-methyl-2-butenyl)-9-(1-hydroxy-1-methylethyl)-12-(2-methyl-1-oxopropyl)-4,12-methano-8-oxabicyclo[5.4.1]dodecane-6-ene-5,13-dione 结构式
Primary record

(1R,2S,4R,9S,12S)-1-Methyl-2,4,6-tris(3-methyl-2-butenyl)-9-(1-hydroxy-1-methylethyl)-12-(2-methyl-1-oxopropyl)-4,12-methano-8-oxabicyclo[5.4.1]dodecane-6-ene-5,13-dione

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
10650360
SMILES
CC(C)C(=O)[C@]12C3=C(C(=O)[C@](C1=O)(C[C@@H]([C@]2(CC[C@H](O3)C(C)(C)O)C)CC=C(C)C)CC=C(C)C)CC=C(C)C
Canonical SMILES
CC(C)=CCC1=C2O[C@H](C(C)(C)O)CC[C@]3(C)[C@@H](CC=C(C)C)C[C@](CC=C(C)C)(C1=O)C(=O)[C@]23C(=O)C(C)C

名称与同义词

  • Oxepahyperforin
  • CHEMBL3581587
  • SCHEMBL29934433
  • CHEBI:176026
  • CID10650360
  • CID 10650360
  • NS00094541
  • J1.276.411A
  • (1R,2S,4R,9S,12S)-1-Methyl-2,4,6-tris(3-methyl-2-butenyl)-9-(1-hydroxy-1-methylethyl)-12-(2-methyl-1-oxopropyl)-4,12-methano-8-oxabicyclo[5.4.1]dodecane-6-ene-5,13-dione
  • (1R,6S,9R,10S,13S)-6-(2-hydroxypropan-2-yl)-9-methyl-1,3,13-tris(3-methylbut-2-en-1-yl)-10-(2-methylpropanoyl)-5-oxatricyclo[7.2.2.04,10]tridec-3-ene-2,11-dione
  • (1R,6S,9R,10S,13S)-6-(2-hydroxypropan-2-yl)-9-methyl-1,3,13-tris(3-methylbut-2-enyl)-10-(2-methylpropanoyl)-5-oxatricyclo[7.2.2.04,10]tridec-3-ene-2,11-dione