TPCN03834

Name Quinquenosides ??
Molecular Formula C60H102O28
Molecular Weight 1271.45
CAS Registry Number 208764-55-0
SMILES CC(C)=CCCC(C)(OC1OC(COC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Araliaceae Panax quinquefolium Roots 0.000520% Chem Pharm Bull (Tokyo), 1998, 46, 647-654. 10.1248/cpb.46.647
Properties
HBA 28 HBD 18
HeavyAtoms 88 AlogP -4.38
TPSA 456.44 RotatableBonds 19
FractionCSP3 0.97 Rings 9
AromaticRings 0 AliphaticRings 9