Name: Locicortolone dicibate
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212684201
Cas No:78467-68-2
常用名:Locicortolone dicibate
IUPAC:(1S,2R,3aS,3bS,9aS,9bR,10S,11aS)-9b,10-dichloro-1-(2-{[(dicyclohexylmethoxy)carbonyl]oxy}acetyl)-2,9a,11a-trimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
IUPAC:(1S,2R,3aS,3bS,9aS,9bR,10S,11aS)-9b,10-dichloro-1-(2-{[(dicyclohexylmethoxy)carbonyl]oxy}acetyl)-2,9a,11a-trimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
InChI key:YHKWQBFYBUXNDL-MCCAODLFSA-N

分子式:C36H50Cl2O5
分子量:633.69
氢键供体数 (HBD):0
氢键受体数 (HBA):4
LogP:9.517883
SMILES:[H][C@@]12C[C@@H](C)[C@H](C(=O)COC(=O)OC(C3CCCCC3)C3CCCCC3)[C@@]1(C)C[C@H](Cl)[C@@]1(Cl)[C@@]2([H])CCC2=CC(=O)C=C[C@]12C |c:45,t:41|
SMILES:[H][C@@]12C[C@@H](C)[C@H](C(=O)COC(=O)OC(C3CCCCC3)C3CCCCC3)[C@@]1(C)C[C@H](Cl)[C@@]1(Cl)[C@@]2([H])CCC2=CC(=O)C=C[C@]12C |c:45,t:41|

Locicortolone dicibate is a synthetic glucocorticoid corticosteroid which was never marketed.

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