Chemical Compound

(1S,3aS,3bR,9bS,11aS)-11a-methyl-1-[2-(3-{2-[2-(2-phenylethynyl)cyclohex-1-en-1-yl]ethynyl}phenyl)ethynyl]-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-diol

(1S,3aS,3bR,9bS,11aS)-11a-methyl-1-[2-(3-{2-[2-(2-phenylethynyl)cyclohex-1-en-1-yl]ethynyl}phenyl)ethynyl]-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-diol 结构式
Primary record

(1S,3aS,3bR,9bS,11aS)-11a-methyl-1-[2-(3-{2-[2-(2-phenylethynyl)cyclohex-1-en-1-yl]ethynyl}phenyl)ethynyl]-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-diol

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
10951974
SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#CC4=CC=CC(=C4)C#CC5=C(CCCC5)C#CC6=CC=CC=C6)O)CCC7=C3C=CC(=C7)O
Canonical SMILES
C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC[C@@]2(O)C#Cc1cccc(C#CC2=C(C#Cc3ccccc3)CCCC2)c1

名称与同义词

  • CID10951974
  • CID 10951974
  • J1.625.793A
  • 17-[[3-[[2-(Phenylethynyl)-1-cyclohexenyl]ethynyl]phenyl]ethynyl]estradiol
  • (1S,3aS,3bR,9bS,11aS)-11a-methyl-1-[2-(3-{2-[2-(2-phenylethynyl)cyclohex-1-en-1-yl]ethynyl}phenyl)ethynyl]-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-diol
  • 17-[3-[2-(Phenylethynyl)-1-cyclohexenylethynyl]phenylethynyl]estra-1,3,5(10)-triene-3,17beta-diol