Chemical Compound

(1R,3aS,3bS,5R,9aS,9bR,10S,11aS)-9b-[(1R,3aS,3bS,5R,9aR,9bS,10S,11aS)-1,5,10-trihydroxy-1-(2-hydroxyacetyl)-9a,11a-dimethyl-7-oxo-2H,3H,3aH,3bH,4H,5H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-9-yl]-1,5,10-trihydroxy-1-(2-hydroxyacetyl)-9a,11a-dimethyl-2H,3H,3aH,3bH,4H,5H,8H,9H,10H,11H-cyclopenta[a]phenanthren-7-one

CAS Registry Number 53-35-0
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(1R,3aS,3bS,5R,9aS,9bR,10S,11aS)-9b-[(1R,3aS,3bS,5R,9aR,9bS,10S,11aS)-1,5,10-trihydroxy-1-(2-hydroxyacetyl)-9a,11a-dimethyl-7-oxo-2H,3H,3aH,3bH,4H,5H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-9-yl]-1,5,10-trihydroxy-1-(2-hydroxyacetyl)-9a,11a-dimethyl-2H,3H,3aH,3bH,4H,5H,8H,9H,10H,11H-cyclopenta[a]phenanthren-7-one 结构式
Primary record

(1R,3aS,3bS,5R,9aS,9bR,10S,11aS)-9b-[(1R,3aS,3bS,5R,9aR,9bS,10S,11aS)-1,5,10-trihydroxy-1-(2-hydroxyacetyl)-9a,11a-dimethyl-7-oxo-2H,3H,3aH,3bH,4H,5H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-9-yl]-1,5,10-trihydroxy-1-(2-hydroxyacetyl)-9a,11a-dimethyl-2H,3H,3aH,3bH,4H,5H,8H,9H,10H,11H-cyclopenta[a]phenanthren-7-one

库存
1,553 克
纯度
99.4 %
CAS
53-35-0

化合物标识与属性

CAS
53-35-0
PubChem CID
170923532
SMILES
C[C@]12CCC(=O)C=C1[C@@H](C[C@@H]3[C@@]2([C@H](C[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C)O)C5CC(=O)C=C6[C@]5([C@@H]7[C@@H](C[C@H]6O)[C@@H]8CC[C@@]([C@]8(C[C@@H]7O)C)(C(=O)CO)O)C)O
Canonical SMILES
C[C@]12CCC(=O)C=C1[C@H](O)C[C@H]1[C@@H]3CC[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12C1CC(=O)C=C2[C@H](O)C[C@@H]3[C@H]([C@@H](O)C[C@@]4(C)[C@H]3CC[C@]4(O)C(=O)CO)[C@]21C

名称与同义词

  • (1R,3aS,3bS,5R,9aS,9bR,10S,11aS)-9b-[(1R,3aS,3bS,5R,9aR,9bS,10S,11aS)-1,5,10-trihydroxy-1-(2-hydroxyacetyl)-9a,11a-dimethyl-7-oxo-2H,3H,3aH,3bH,4H,5H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-9-yl]-1,5,10-trihydroxy-1-(2-hydroxyacetyl)-9a,11a-dimethyl-2H,3H,3aH,3bH,4H,5H,8H,9H,10H,11H-cyclopenta[a]phenanthren-7-one
  • 53-35-0