TPCN00231

Name Monardins C
Molecular Formula C16H24O7
Molecular Weight 328.36
CAS Registry Number 1262796-93-9
SMILES CC(C)c1ccc(CO)c(OC2OC(CO)C(O)C(O)C2O)c1
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Apocynaceae Monarda punctata Whole plants 0.001063% Phytochemistry, 2010, 71, 1884-1891. 10.1016/j.phytochem.2010.08.009
Properties
HBA 7 HBD 5
HeavyAtoms 23 AlogP -0.52
TPSA 119.61 RotatableBonds 5
FractionCSP3 0.63 Rings 2
AromaticRings 1 AliphaticRings 1