TPCN01390

Name 4H-tomentosin
Molecular Formula C15H22O3
Molecular Weight 250.34
CAS Registry Number 68776-19-2
SMILES C=C1C(=O)OC2CC(C)C(CCC(C)O)=CCC12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Inula hupehensis Aerial parts 0.000582% Planta Med 78(10): 1002-1009.(2012) 10.1055/s-0031-1298621
Properties
HBA 3 HBD 1
HeavyAtoms 18 AlogP 2.60
TPSA 46.53 RotatableBonds 3
FractionCSP3 0.67 Rings 2
AromaticRings 0 AliphaticRings 2