TPCN01206

Name Wedelolides B
Molecular Formula C24H32O8
Molecular Weight 448.51
CAS Registry Number 950766-70-8
SMILES C=C(C)C(=O)OC1C2C(=C)C(=O)OC(C2OC(=O)C(C)=CC)C2(C)C(O)CCC(C)(O)C12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Wedelia trilobata Leaves 0.001333% J Org Chem 72(19): 7102-7105.(2007) 10.1021/jo070771m
Properties
HBA 8 HBD 2
HeavyAtoms 32 AlogP 1.99
TPSA 119.36 RotatableBonds 4
FractionCSP3 0.63 Rings 3
AromaticRings 0 AliphaticRings 3