TPCN03127

Name Crotocascarins P
Molecular Formula C25H34O8
Molecular Weight 462.54
CAS Registry Number 2247529-71-9
SMILES C=C1C(O)CC2OC(=O)C(C)=C2C2C1C13OC1(CC(C)C3OC(=O)C(C)CC)C(O)C2(C)O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Euphorbiaceae Croton cascarilloides Stems 0.000055% Chem Pharm Bull (Tokyo) 64, 1492-1498 (2016). 10.1248/cpb.c16-00500
Properties
HBA 8 HBD 3
HeavyAtoms 33 AlogP 1.41
TPSA 125.82 RotatableBonds 3
FractionCSP3 0.76 Rings 5
AromaticRings 0 AliphaticRings 5