TPCN04054

Name Chikusetsusaponin FK6
Molecular Formula C53H90O22
Molecular Weight 1079.28
CAS Registry Number 1407488-54-3
SMILES CC(C)=CCCC(C)(OC1OC(CO)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(COC5OCC(O)C(O)C5O)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 japonicus Fruits 0.000102% Chem Pharm Bull (Tokyo), 2012, 60, 354-362. 10.1248/cpb.60.354
Araliaceae Panax japonicus Fruits 0.000017% Chem Pharm Bull (Tokyo), 2012, 60, 354-362. 10.1248/cpb.60.354
Properties
HBA 22 HBD 14
HeavyAtoms 75 AlogP -1.56
TPSA 357.06 RotatableBonds 15
FractionCSP3 0.96 Rings 8
AromaticRings 0 AliphaticRings 8