TPCN04396

Name 24-Nor-3-oxo-lup-20(29)-en-28-oic-acid-28-O-??-Lrhammnopyranosyl(1??4)-??-D-glucopyranosyl (1??6)-??-D-glucopyranoside
Molecular Formula C47H74O17
Molecular Weight 911.09
CAS Registry Number 1259116-95-4
SMILES C=C(C)C1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(CCC4C5(C)CCC(=O)C(C)C5CCC43C)C12
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Araliaceae Oplopanax horridus Leaves 0.000889% Nat Prod Commun 5(7): 1019-1022. 10.1177/1934578X1000500706
Properties
HBA 17 HBD 9
HeavyAtoms 64 AlogP 0.84
TPSA 271.59 RotatableBonds 9
FractionCSP3 0.91 Rings 8
AromaticRings 0 AliphaticRings 8