Name: (1S,3aS,3bS,9aR,9bS,11aS)-1-[(2,2,2-2H3)acetyl]-9a,11a-dimethyl(1,5,5,6,8,8-2H6)-2H,3H,3aH,3bH,4H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-one
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HIT ID:HIT217600180
Cas No:15775-74-3
常用名:(1S,3aS,3bS,9aR,9bS,11aS)-1-[(2,2,2-2H3)acetyl]-9a,11a-dimethyl(1,5,5,6,8,8-2H6)-2H,3H,3aH,3bH,4H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-one
常用名:(1S,3aS,3bS,9aR,9bS,11aS)-1-[(2,2,2-2H3)acetyl]-9a,11a-dimethyl(1,5,5,6,8,8-2H6)-2H,3H,3aH,3bH,4H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-one
IUPAC:(1S,3aS,3bS,9aR,9bS,11aS)-1-[(2,2,2-2H3)acetyl]-9a,11a-dimethyl(1,5,5,6,8,8-2H6)-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
IUPAC:(1S,3aS,3bS,9aR,9bS,11aS)-1-[(2,2,2-2H3)acetyl]-9a,11a-dimethyl(1,5,5,6,8,8-2H6)-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
InChI key:RJKFOVLPORLFTN-PQIPVKAESA-N

分子式:C21H30O2
分子量:323.524
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[2H]C1=C2C([2H])([2H])C[C@H]3[C@@H]4CC[C@]([2H])(C(=O)C([2H])([2H])[2H])[C@@]4(C)CC[C@@H]3[C@@]2(C)CC([2H])([2H])C1=O
SMILES:[2H]C1=C2C([2H])([2H])C[C@H]3[C@@H]4CC[C@]([2H])(C(=O)C([2H])([2H])[2H])[C@@]4(C)CC[C@@H]3[C@@]2(C)CC([2H])([2H])C1=O

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