Megestrol Acetate-d3
HIT218833176
sdf文件结构编辑类似物检索
HIT ID: HIT218833176
Cas No:
分子式: C24H32O4
分子量: 387.534
常用名: Megestrol Acetate-d3
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (1R,3aS,3bR,9aR,9bS,11aS)-1-acetyl-5-(2H3)methyl-9a,11a-dimethyl-7-oxo-1H,2H,3H,3aH,3bH,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl acetate
IUPAC: (1R,3aS,3bR,9aR,9bS,11aS)-1-acetyl-5-(2H3)methyl-9a,11a-dimethyl-7-oxo-1H,2H,3H,3aH,3bH,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl acetate
SMILES: [H][C@@]12CC[C@](OC(C)=O)(C(C)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])C=C(C2=CC(=O)CC[C@]12C)C([2H])([2H])[2H]
SMILES: [H][C@@]12CC[C@](OC(C)=O)(C(C)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])C=C(C2=CC(=O)CC[C@]12C)C([2H])([2H])[2H]
InChI key: RQZAXGRLVPAYTJ-CPPTVPENSA-N
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