TPCN03572

Name Chikusetsusaponin IV;Araloside A
Molecular Formula C47H74O18
Molecular Weight 927.09
CAS Registry Number 7518-22-1
SMILES CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)O)C(OC7OC(CO)C(O)C7O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Caryophyllaceae Sinocrassula asclepiadea Roots 0.002444% Chem Pharm Bull (Tokyo) 52, 230-237 (2004). 10.1248/cpb.52.230
Caryophyllaceae Sinocrassula asclepiadea Roots 0.001111% Chem Pharm Bull (Tokyo) 52, 230-237 (2004). 10.1248/cpb.52.230
Araliaceae Panax japonicus Roots 0.000552% J Nat Prod 79(12): 3079-3085. 10.1021/acs.jnatprod.6b00748
Properties
HBA 18 HBD 10
HeavyAtoms 65 AlogP 0.87
TPSA 291.82 RotatableBonds 9
FractionCSP3 0.91 Rings 8
AromaticRings 0 AliphaticRings 8