TPCN06278

Name Nayabin A
Molecular Formula C42H68O14
Molecular Weight 796.99
CAS Registry Number 2143123-41-3
SMILES C=C(C)C1CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(COC6OC(CO)C(O)C(O)C6O)C5CCC43C)C12
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Zygophyllaceae Fagonia indica Whole plants 0.000071% Phytochemistry . 2017 Nov;143:151-159 10.1016/j.phytochem.2017.08.005
Properties
HBA 14 HBD 9
HeavyAtoms 56 AlogP 1.14
TPSA 236.06 RotatableBonds 8
FractionCSP3 0.93 Rings 7
AromaticRings 0 AliphaticRings 7