Chemical Compound

(2S)-3-{[(3aS,3bR,9bS,11aS)-6,7-dihydroxy-11a-methyl-1-oxo-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-8-yl]sulfanyl}-2-aminopropanoic acid

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(2S)-3-{[(3aS,3bR,9bS,11aS)-6,7-dihydroxy-11a-methyl-1-oxo-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-8-yl]sulfanyl}-2-aminopropanoic acid 结构式
Primary record

(2S)-3-{[(3aS,3bR,9bS,11aS)-6,7-dihydroxy-11a-methyl-1-oxo-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-8-yl]sulfanyl}-2-aminopropanoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
102586423
SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=C(C(=C(C=C34)SC[C@H](C(=O)O)N)O)O
Canonical SMILES
C[C@]12CC[C@@H]3c4cc(SC[C@@H](N)C(=O)O)c(O)c(O)c4CC[C@H]3[C@@H]1CCC2=O

名称与同义词

  • J994.996H
  • 2-[[(2S)-2-Amino-3-hydroxy-3-oxopropyl]thio]-4-hydroxyestrone
  • (2S)-3-{[(3aS,3bR,9bS,11aS)-6,7-dihydroxy-11a-methyl-1-oxo-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-8-yl]sulfanyl}-2-aminopropanoic acid