HIT ID: HIT218832918

Cas No:

分子式: C47H80O2

分子量: 677.155

常用名: 9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-yl icosa-11,14-dienoate, Cholesteryl 11,14-Eicosadienoate

氢键受体数 (HBA):

氢键供体数 (HBD):

LogP:

IUPAC: 9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl icosa-11,14-dienoate

SMILES: CCCCCC=CCC=CCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C

InChI key: REFJKOQDWJELKE-UHFFFAOYSA-N