TPCN02291

Name Cubelin
Molecular Formula C20H28O3
Molecular Weight 316.44
CAS Registry Number 1778736-20-1
SMILES CC(C)=CCC1C(C)=CC=C(C=O)C1(C)C(=O)C=CC(C)(C)O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lauraceae Litsea cubeba Fruits 0.003200% Molecules 19, 6838-6850 (2014). 10.3390/molecules19056838
Properties
HBA 3 HBD 1
HeavyAtoms 23 AlogP 3.95
TPSA 54.37 RotatableBonds 6
FractionCSP3 0.50 Rings 1
AromaticRings 0 AliphaticRings 1