TPCN00954

Name Taraxinic acid beta-glucopyranosyl ester;Taraxinic acid ??-D-glucopyranosyl ester
Molecular Formula C21H28O9
Molecular Weight 424.45
CAS Registry Number 75911-14-7
SMILES C=C1C(=O)OC2C=C(C)CCC=C(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Taraxacum officinale Leaves 0.007212% J Med Food 20(1): 71-78.(2017) 10.1089/jmf.2016.0105
Asteraceae Taraxacum obovatum Roots 0.000980% Planta Med 69(2): 181-183.(2003) 10.1055/s-2003-37702
Properties
HBA 9 HBD 4
HeavyAtoms 30 AlogP -0.13
TPSA 142.75 RotatableBonds 3
FractionCSP3 0.62 Rings 3
AromaticRings 0 AliphaticRings 3