HIT ID: HIT218832921

Cas No:

分子式: C27H44O3

分子量: 416.646

常用名: 7-hydroxy-1-(6-hydroxy-6-methylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-4-one, 7-keto-25-hydroxy Cholesterol

氢键受体数 (HBA):

氢键供体数 (HBD):

LogP:

IUPAC: 7-hydroxy-1-(6-hydroxy-6-methylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-4-one

SMILES: CC(CCCC(C)(C)O)C1CCC2C3C(CCC12C)C1(C)CCC(O)CC1=CC3=O

InChI key: NQBVGGWSAXBLBE-UHFFFAOYSA-N