TPCN03383

Name Caryopterisoid L
Molecular Formula C22H34O4
Molecular Weight 362.51
CAS Registry Number 2738369-43-0
SMILES CC(=O)OCC1=CCCC2C1(C)CCC(C)C2(C)CCC(C)=CC(=O)O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Caryopteris glutinosa Whole plants 0.000160% None 10.1016/j.phytochem.2020.112534
Properties
HBA 4 HBD 1
HeavyAtoms 26 AlogP 5.14
TPSA 63.60 RotatableBonds 6
FractionCSP3 0.73 Rings 2
AromaticRings 0 AliphaticRings 2