TPCN01026

Name Rhaserolide
Molecular Formula C21H26O8
Molecular Weight 406.43
CAS Registry Number 258520-65-9
SMILES C=C(C)C(=O)OC1CC(=C)C2CC(O)C(O)(COC(C)=O)C2C2OC(=O)C(=C)C12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Apiaceae Cousinia aitchisonii Whole plants 0.003700% Phytother Res 30(2): 222-226.(2016) 10.1002/ptr.5519
Properties
HBA 8 HBD 2
HeavyAtoms 29 AlogP 0.82
TPSA 119.36 RotatableBonds 4
FractionCSP3 0.57 Rings 3
AromaticRings 0 AliphaticRings 3