TPCN01716

Name Blumeaenes F
Molecular Formula C20H30O6
Molecular Weight 366.45
CAS Registry Number 1295573-40-8
SMILES CC1=C2C(=O)C(C(C)C)CC(OC(=O)C3(C)OC3C)C(C)(O)C2(O)CC1
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Blumea balsamifera Aerial parts 0.000169% Planta Med 76(9): 897-902.(2010) 10.1055/s-0029-1240800
Properties
HBA 6 HBD 2
HeavyAtoms 26 AlogP 1.91
TPSA 96.36 RotatableBonds 3
FractionCSP3 0.80 Rings 3
AromaticRings 0 AliphaticRings 3