TPCN04897

Name 3-O-??-D-glucuronopyranosyloleanolic acid (glycoside F)
Molecular Formula C51H84O23
Molecular Weight 1065.21
CAS Registry Number 94992-08-2
SMILES CC(CCC1(O)OC2CC3C4CC=C5CC(OC6OC(CO)C(OC7OC(CO)C(O)C(O)C7O)C(O)C6OC6OC(C)C(O)C(O)C6O)CCC5(C)C4CCC3(C)C2C1C)COC1OC(CO)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Caryocaraceae Caryocar glabrum Fruits 0.010084% J Nat Prod 69, 196-205 (2006) 10.1021/np050336s
Properties
HBA 23 HBD 14
HeavyAtoms 74 AlogP -3.01
TPSA 366.29 RotatableBonds 15
FractionCSP3 0.96 Rings 9
AromaticRings 0 AliphaticRings 9