TPCN02221

Name
Molecular Formula C20H26O3
Molecular Weight 314.43
CAS Registry Number 864817-63-0
SMILES CC1=C(CCc2ccoc2)C2(C)CCCC(C)(C)C2=C(O)C1=O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Leonurus japonicus Whole plants 0.006471% Molecules 20, 839-845 (2015). 10.3390/molecules20010839
Properties
HBA 3 HBD 1
HeavyAtoms 23 AlogP 5.14
TPSA 50.44 RotatableBonds 3
FractionCSP3 0.55 Rings 3
AromaticRings 1 AliphaticRings 2