TPCN03937

Name Quinquenosides ??
Molecular Formula C62H104O24
Molecular Weight 1233.49
CAS Registry Number 208764-52-7
SMILES CCCCCC=CC(=O)OCC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CC(O)C4C(C(C)(CCC=C(C)C)OC6OC(COC7OC(CO)C(O)C(O)C7O)C(O)C(O)C6O)CCC45C)C3(C)C)OC(CO)C(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Araliaceae Panax quinquefolium Roots 0.000270% Chem Pharm Bull (Tokyo), 1998, 46, 647-654. 10.1248/cpb.46.647
Properties
HBA 24 HBD 14
HeavyAtoms 86 AlogP 0.48
TPSA 383.36 RotatableBonds 22
FractionCSP3 0.92 Rings 8
AromaticRings 0 AliphaticRings 8