Chemical Compound

(1R,3aS,3bS,9bS,10S,11aS)-6-fluoro-1-[(1E)-2-iodoethenyl]-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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(1R,3aS,3bS,9bS,10S,11aS)-6-fluoro-1-[(1E)-2-iodoethenyl]-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

(1R,3aS,3bS,9bS,10S,11aS)-6-fluoro-1-[(1E)-2-iodoethenyl]-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
53318446
SMILES
C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1CC[C@]2(/C=C/I)O)CCC4=C3C=CC(=C4F)O)OC
Canonical SMILES
CO[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)/C=C/I)[C@@H]2CCc3c(ccc(O)c3F)[C@H]21

名称与同义词

  • CHEMBL1628166
  • J564.762B
  • 4-Fluoro-11beta-methoxy-17-[(E)-2-iodoethenyl]-17beta-estradiol
  • (1R,3aS,3bS,9bS,10S,11aS)-6-fluoro-1-[(1E)-2-iodoethenyl]-10-methoxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-diol