TPCN03661

Name Congmuyenoside I
Molecular Formula C48H78O19
Molecular Weight 959.13
CAS Registry Number 1417579-26-0
SMILES CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)C(O)CC3(C)C(=CCC4C5(C)CCC(OC6OC(CO)C(O)C(OC7OC(CO)C(O)C(O)C7O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Araliaceae Aralia elata Leaves 0.001300% Food Chem 138, 208-213 (2013). 10.1016/j.foodchem.2012.10.041
Properties
HBA 19 HBD 12
HeavyAtoms 67 AlogP -0.89
TPSA 315.21 RotatableBonds 9
FractionCSP3 0.94 Rings 8
AromaticRings 0 AliphaticRings 8