HIT ID: HIT100672024

Cas No: 79-63-0

分子式: C30H50O

分子量: 426.729

常用名: LANOSTEROL

氢键受体数 (HBA): 1

氢键供体数 (HBD): 1

LogP: 1.059300000000000e+001

IUPAC: (1R,3aR,5aR,7S,9aS,11aR)-3a,6,6,9a,11a-pentamethyl-1-[(2R)-6-methylhept-5-en-2-yl]-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol

SMILES: [#6]-[#6@H](-[#6]-[#6]\[#6]=[#6](/[#6])-[#6])-[#6@H]1-[#6]-[#6][C@@]2([#6])[#6]-3=[#6](-[#6]-[#6][C@]12[#6])[C@@]1([#6])[#6]-[#6]-[#6@H](-[#8])C([#6])([#6])[#6@@H]1-[#6]-[#6]-3 |c:13|

InChI key: CAHGCLMLTWQZNJ-BQNIITSRSA-N