TPCN02845

Name Bicrotonol A
Molecular Formula C40H68O4
Molecular Weight 612.98
CAS Registry Number 2194542-00-0
SMILES CC1(CC2OC(O)CC3(C)OC4(C)CCC5C(C)(C)CCCC5(C)C4CC23)CCC2C(C)(CCC3C(C)(C)CCCC32C)O1
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Euphorbiaceae Croton crassifolius Roots 0.000211% Org Biomol Chem 16, 1745-1750 (2018). 10.1039/c7ob02991h
Properties
HBA 4 HBD 1
HeavyAtoms 44 AlogP 9.85
TPSA 47.92 RotatableBonds 2
FractionCSP3 1.00 Rings 7
AromaticRings 0 AliphaticRings 7