TPCN02985

Name Macroricasbalone A
Molecular Formula C20H30O2
Molecular Weight 302.46
CAS Registry Number 1850331-17-7
SMILES CC1=CCC(=O)C(C)=CC2C(CCC3(C)OC3CC1)C2(C)C
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Euphorbiaceae Euphorbia macrorrhiza Whole plants 0.000124% Phytochemistry 122, 246-253 (2016). 10.1016/j.phytochem.2015.12.003
Properties
HBA 2 HBD 0
HeavyAtoms 22 AlogP 4.84
TPSA 29.60 RotatableBonds 0
FractionCSP3 0.75 Rings 3
AromaticRings 0 AliphaticRings 3