HIT ID: HIT101053778

Cas No: 50334-39-9;110115-60-1

分子式: C15H20O3

分子量: 248.322

常用名: Graveolide

氢键受体数 (HBA): 2

氢键供体数 (HBD): 0

LogP: 3.038

IUPAC: (3aR,4aS,7aS,8R,9aS)-4a,8-dimethyl-3-methylidene-dodecahydroazuleno[6,5-b]furan-2,5-dione

SMILES: C[C@@H]1C[C@@H]2OC(=O)C(=C)[C@H]2C[C@@]2(C)[C@H]1CCC2=O

InChI key: DCKYPAZZUYXYTC-SCGWIAOYSA-N