TPCN04586

Name 3-O-??-D-glucopyranosyl(1??2)-[??-D-glucopyranosyl-(1??4)]-??-L-arabinopyranosyl13,28-epoxy-3??-hydroxy-16-oleanaone
Molecular Formula C47H76O17
Molecular Weight 913.11
CAS Registry Number 918959-47-4
SMILES CC1(C)CCC23COC4(CCC5C6(C)CCC(OC7OCC(OC8OC(CO)C(O)C(O)C8O)C(O)C7OC7OC(CO)C(O)C(O)C7O)C(C)(C)C6CCC5(C)C4(C)CC2=O)C3C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Primulaceae Lysimachia davurica Whole plants 0.000220% Chem Pharm Bull (Tokyo) 54(10): 1380-1383. 10.1248/cpb.54.1380
Properties
HBA 17 HBD 9
HeavyAtoms 64 AlogP 0.67
TPSA 263.75 RotatableBonds 8
FractionCSP3 0.98 Rings 9
AromaticRings 0 AliphaticRings 9