TPCN03043

Name
Molecular Formula C20H34O3
Molecular Weight 322.49
CAS Registry Number 1349700-47-5
SMILES CC(=CCO)CCC1(O)C(C)C(=O)CC2C(C)(C)CCCC21C
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Leonurus japonicus Whole plants 0.000090% Molecules 18, 13904-13909 (2013). 10.3390/molecules181113904
Properties
HBA 3 HBD 2
HeavyAtoms 23 AlogP 3.88
TPSA 57.53 RotatableBonds 4
FractionCSP3 0.85 Rings 2
AromaticRings 0 AliphaticRings 2