Chemical Compound

(1S,3aS,3bS,9bS,10S,11aS)-1-(2-chloroethynyl)-10-methoxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-diol

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(1S,3aS,3bS,9bS,10S,11aS)-1-(2-chloroethynyl)-10-methoxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-diol 结构式
Primary record

(1S,3aS,3bS,9bS,10S,11aS)-1-(2-chloroethynyl)-10-methoxy-11a-methyl-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
53317670
SMILES
C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1CC[C@]2(C#CCl)O)CCC4=C3C=CC(=C4)O)OC
Canonical SMILES
CO[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#CCl)[C@@H]2CCc3cc(O)ccc3[C@H]21

名称与同义词

  • CHEMBL1628052
  • J575.718E
  • 11beta-Methoxy-17-(chloroethynyl)-17beta-estradiol
  • (1S,3aS,3bS,9bS,10S,11aS)-1-(2-chloroethynyl)-10-methoxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-diol