TPCN06209

Name 3??-hydroxy-30-noroleana-12,20(29)-dien-28-oic acid ??-D-glucopyranosyl ester
Molecular Formula C35H54O8
Molecular Weight 602.81
CAS Registry Number 1242333-66-9
SMILES C=C1CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Zygophyllaceae Larrea tridentata Aerial parts 0.000247% Phytochemistry . 2010 Dec;71(17-18):2157-67 10.1016/j.phytochem.2010.09.012
Properties
HBA 8 HBD 5
HeavyAtoms 43 AlogP 4.02
TPSA 136.68 RotatableBonds 3
FractionCSP3 0.86 Rings 6
AromaticRings 0 AliphaticRings 6