TPCN02038

Name Cornucadinoside E
Molecular Formula C27H36O13
Molecular Weight 568.57
CAS Registry Number 2263977-31-5
SMILES Cc1c(OC2OC(CO)C(O)C(O)C2O)c(OC2OC(CO)C(O)C(O)C2O)c2c(C)ccc3c2c1OCC3C
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Cornaceae Cornus officinalis Fruits 0.000011% Bioorg Chem 82: 1-5.(2019) 10.1016/j.bioorg.2018.09.026
Properties
HBA 13 HBD 8
HeavyAtoms 40 AlogP -1.69
TPSA 207.99 RotatableBonds 6
FractionCSP3 0.63 Rings 5
AromaticRings 2 AliphaticRings 3