TPCN01116

Name Daucucarotol
Molecular Formula C15H28O3
Molecular Weight 256.39
CAS Registry Number 1190765-66-2
SMILES CC(C)(O)C1CC2C(CO)CCCC2C(C)(O)C1
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Apiaceae Daucus carota Fruits 0.002200% Molecules 14(8): 2862-2867.(2009) 10.3390/molecules14082862
Properties
HBA 3 HBD 3
HeavyAtoms 18 AlogP 1.94
TPSA 60.69 RotatableBonds 2
FractionCSP3 1.00 Rings 2
AromaticRings 0 AliphaticRings 2