Poststerone
HIT213886763
sdf文件结构编辑类似物检索
HIT ID: HIT213886763
Cas No:
分子式: C21H30O5
分子量: 362.466
常用名: Poststerone
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (1S,3aS,5aR,7R,8S,9aR,9bR,11aR)-1-acetyl-3a,7,8-trihydroxy-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-5-one
IUPAC: (1S,3aS,5aR,7R,8S,9aR,9bR,11aR)-1-acetyl-3a,7,8-trihydroxy-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-5-one
SMILES: CC(=O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C |t:8|
SMILES: CC(=O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C |t:8|
InChI key: VNLQNGYIXVTQRR-NQPIQAHSSA-N
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