TPCN06008

Name 3-[(O-??-D-glucopyranosyl-(1??3)-O-[??-L-rhamnopyranosyl-(1??2)]-??-L-arabinopyranosyl)oxy]-30-noroleana-12,20(29)- dien-28-oic acid O-??-D-glucopyranosyl-(1??6)-??-D-glucopyranosyl ester
Molecular Formula C58H92O26
Molecular Weight 1205.35
CAS Registry Number 1260096-79-4
SMILES C=C1CCC2(C(=O)OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(OC7OC(CO)C(O)C(O)C7O)C6OC6OC(C)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Zygophyllaceae Larrea tridentata Aerial parts 0.003077% Phytochemistry . 2010 Dec;71(17-18):2157-67 10.1016/j.phytochem.2010.09.012
Properties
HBA 26 HBD 15
HeavyAtoms 84 AlogP -3.01
TPSA 412.82 RotatableBonds 13
FractionCSP3 0.91 Rings 10
AromaticRings 0 AliphaticRings 10