TPCN03069

Name Crotonol A
Molecular Formula C20H28O9
Molecular Weight 412.44
CAS Registry Number 2307233-82-3
SMILES CC1=CC2C(O)(CC(O)(CO)C3(O)OC(C)(C)C4C(O)C(=O)C(C)C2(O)C43)C1=O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Euphorbiaceae Croton tiglium Leaves 0.000079% Org Biomol Chem 17, 195-202 (2018). 10.1039/c8ob02519c
Properties
HBA 9 HBD 6
HeavyAtoms 29 AlogP -1.97
TPSA 164.75 RotatableBonds 1
FractionCSP3 0.80 Rings 4
AromaticRings 0 AliphaticRings 4