TPCN03494

Name Xerophilsin F
Molecular Formula C23H32O8
Molecular Weight 436.50
CAS Registry Number 2756375-08-1
SMILES COCC1C(=O)C23C4OC5OC2(O)C(O)C2C(C)(C)CCCC52C3C(OC(C)=O)CC14
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Isodon xerophilus Aerial parts 0.000015% None 10.1021/acs.jnatprod.0c00983
Properties
HBA 8 HBD 2
HeavyAtoms 31 AlogP 1.02
TPSA 111.52 RotatableBonds 3
FractionCSP3 0.91 Rings 8
AromaticRings 0 AliphaticRings 8