HIT218679500 - 6-{3,7-dihydroxy-3a,6,6,9a,11a-pentamethyl-10-oxo-1H,2H,3H,4H,5H,5aH,7H,8H,9H,11H-cyclopenta[a]phenanthren-1-yl}-2-methyl-4-oxoheptanoic acid, Ganolucidic acid B

sdf文件结构编辑类似物检索

HIT ID: HIT218679500

Cas No:

分子式: C30H46O6

分子量: 502.692

常用名: 6-{3,7-dihydroxy-3a,6,6,9a,11a-pentamethyl-10-oxo-1H,2H,3H,4H,5H,5aH,7H,8H,9H,11H-cyclopenta[a]phenanthren-1-yl}-2-methyl-4-oxoheptanoic acid, Ganolucidic acid B

氢键受体数 (HBA):

氢键供体数 (HBD):

LogP:

IUPAC: 6-{3,7-dihydroxy-3a,6,6,9a,11a-pentamethyl-10-oxo-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl}-2-methyl-4-oxoheptanoic acid

SMILES: CC(CC(=O)CC(C)C(O)=O)C1CC(O)C2(C)C3=C(C(=O)CC12C)C1(C)CCC(O)C(C)(C)C1CC3

InChI key: YPYHGMCHNBTMDB-UHFFFAOYSA-N