Chemical Compound

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

CAS Registry Number 90746-94-4
(2S,3S,4S,5R,6S)-6-{[(1S,3aS,3bR,9bS,11aS)-1,6-dihydroxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid 结构式
Primary record

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

库存
1,876 克
纯度
99.3 %
CAS
90746-94-4

化合物标识与属性

CAS
90746-94-4
PubChem CID
101608815
SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O
Canonical SMILES
C[C@]12CC[C@@H]3c4ccc(O[C@@H]5O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]5O)c(O)c4CC[C@H]3[C@@H]1CC[C@@H]2O

名称与同义词

  • 4-hydroxyestradiol 3-glucuronide
  • 4-OHE2 3G
  • CHEBI:137911
  • 4-Hydroxyestradiol-3-O-b-D-glucuronide
  • 4-Hydroxyestradiol 3-O-b-D-Glucuronide
  • 4-hydroxy-17beta-estradiol 3-glucuronide
  • 4-Hydroxyestradiol 3-O-Beta-D-Glucuronide
  • J418.328B
  • 4-hydroxy-17beta-estradiol 3-beta-glucuronide
  • 4-hydroxy-17beta-estradiol 3-(beta-D-glucuronide)
  • 4-hydroxy-17beta-estradiol 3-O-(beta-D-glucuronide)
  • Q55927515
  • 90746-94-4
  • 3-(beta-D-Glucurono pyranosyloxy)estra-1,3,5(10)-triene-4,17beta-diol
  • (17beta)-4,17-dihydroxyestra-1(10),2,4-trien-3-yl beta-D-glucopyranosiduronic acid
  • (17beta)-4,17-dihydroxyestra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronic acid
  • 4,17beta-dihydroxyestra-1(10),2,4-trien-3-yl beta-D-glucopyranosiduronic acid
  • (17beta)-4,17-Dihydroxyestra-1,3,5(10)-trien-3-yl beta-D-Glucopyranosiduronic Acid; 4-Hydroxyestradiol 3-Glucuronide; Estrane beta-D-Glucopyranosiduronic Acid derivative
  • (2S,3S,4S,5R,6S)-6-{[(1S,3aS,3bR,9bS,11aS)-1,6-dihydroxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid