TPCN03777

Name Yiyeliangwanoside XI
Molecular Formula C53H84O23
Molecular Weight 1089.23
CAS Registry Number 162811-51-0
SMILES CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CCC(C)(C(=O)O)CC4C4=CCC6C7(C)CCC(OC8OCC(O)C(O)C8O)C(C)(C)C7CCC6(C)C4(C)CC5)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Araliaceae Metapanax davidii Barks 0.000727% Phytochemistry, 1995, 38, 695-698. 10.1016/0031-9422(94)00706-y
Properties
HBA 23 HBD 13
HeavyAtoms 76 AlogP -1.30
TPSA 370.97 RotatableBonds 11
FractionCSP3 0.92 Rings 9
AromaticRings 0 AliphaticRings 9