TPCN00203

Name Parkinsenes B
Molecular Formula C16H24O6
Molecular Weight 312.36
CAS Registry Number 1571094-99-9
SMILES C=CC1(C)CCC=C(C)C(=O)OC2C(O)C(C)OC(O1)C2O
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Parkinsonia aculeata Aerial parts 0.001333% Cell Biochem Biophys, 2013, 65, 301-313. 10.1007/s12013-012-9433-3
Properties
HBA 6 HBD 2
HeavyAtoms 22 AlogP 1.07
TPSA 85.22 RotatableBonds 1
FractionCSP3 0.69 Rings 2
AromaticRings 0 AliphaticRings 2