TPCN01904

Name Britanin
Molecular Formula C19H26O7
Molecular Weight 366.41
CAS Registry Number 33627-28-0
SMILES C=C1C(=O)OC2CC(C)C3C(OC(C)=O)CC(O)C3(C)C(OC(C)=O)C12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Inula hupehensis Aerial parts 0.000056% Arch Pharm Res 36(11): 1319-1325.(2013) 10.1007/s12272-013-0135-1
Properties
HBA 7 HBD 1
HeavyAtoms 26 AlogP 1.37
TPSA 99.13 RotatableBonds 2
FractionCSP3 0.74 Rings 3
AromaticRings 0 AliphaticRings 3