Chemical Compound

J994.990I

J994.990I chemical structure
Primary Record

J994.990I

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
102507491
SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=C(C(=C(C=C34)O)O)SC[C@H](C(=O)O)N
Canonical SMILES
C[C@]12CC[C@@H]3c4cc(O)c(O)c(SC[C@@H](N)C(=O)O)c4CC[C@H]3[C@@H]1CCC2=O

Names & Synonyms

  • J994.990I
  • 4-[[(2S)-2-Amino-3-hydroxy-3-oxopropyl]thio]-2-hydroxyestrone
  • (2S)-3-{[(3aS,3bR,9bS,11aS)-7,8-dihydroxy-11a-methyl-1-oxo-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-6-yl]sulfanyl}-2-aminopropanoic acid