TPCN04349

Name 3??-[(??-L-arabinopyranosyl)oxy]-16??-hydroxyolean-12-en-28-oic acid
Molecular Formula C35H56O8
Molecular Weight 604.83
CAS Registry Number 68579-28-2
SMILES CC1(C)CCC2(C(=O)O)C(O)CC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Berberidaceae Caulophyllum thalictroides Aerial parts 0.001255% J Nat Prod 72(6): 1155-1160. 10.1021/np900164b
Properties
HBA 8 HBD 5
HeavyAtoms 43 AlogP 4.67
TPSA 136.68 RotatableBonds 3
FractionCSP3 0.91 Rings 6
AromaticRings 0 AliphaticRings 6