TPCN01500

Name Blumeoidolide-C
Molecular Formula C22H30O8
Molecular Weight 422.47
CAS Registry Number 1639406-72-6
SMILES C=C1C(=O)OC2C1C(OC(=O)C(C)(O)C(C)OC(C)=O)CC1(C)C(O)CC=C(C)C21
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Vernonia blumeoides Aerial parts 0.000379% Phytochemistry 111, 163-168.(2015) 10.1016/j.phytochem.2014.11.010
Properties
HBA 8 HBD 2
HeavyAtoms 30 AlogP 1.44
TPSA 119.36 RotatableBonds 4
FractionCSP3 0.68 Rings 3
AromaticRings 0 AliphaticRings 3