TPCN04976

Name Nizwanone
Molecular Formula C30H48O2
Molecular Weight 440.71
CAS Registry Number 1453186-51-0
SMILES CC1CCC2(C)CCC3(C)C(=CCC4C5(C)CCC(=O)C(C)(C)C5CC(O)C43C)C2C1C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Burseraceae Boswellia sacra Aerial parts 0.002880% Chem Biodivers 10, 1501-1506 (2013). 10.1002/cbdv.201200231
Properties
HBA 2 HBD 1
HeavyAtoms 32 AlogP 7.20
TPSA 37.30 RotatableBonds 0
FractionCSP3 0.90 Rings 5
AromaticRings 0 AliphaticRings 5