TPCN00895

Name Trilobolide 6-O-methacrylate
Molecular Formula C23H30O9
Molecular Weight 450.48
CAS Registry Number 950685-51-5
SMILES C=C(C)C(=O)OC1C2C(=C)C(=O)OC2C(OC(C)=O)C2(C)C(OC(C)=O)CCC(C)(O)C12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Wedelia trilobata Leaves 0.013778% J Org Chem 72(19): 7102-7105.(2007) 10.1021/jo070771m
Properties
HBA 9 HBD 1
HeavyAtoms 32 AlogP 1.62
TPSA 125.43 RotatableBonds 4
FractionCSP3 0.65 Rings 3
AromaticRings 0 AliphaticRings 3