TPCN04985

Name 3-O-??-D-galactopyranosyl-(1??3)-??-D-glucuronopy-ranosyloleanolic acid 28-O-??-D-glucopyranosyl ester (glycoside C)
Molecular Formula C47H76O18
Molecular Weight 929.11
CAS Registry Number 84331-61-3
SMILES CC1(COC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2OC2OC(CO)C(O)C2O)CCCC2(C)C1CCC1(C)C2CCC2C1(C)CCC1(O)C3CCC21C(=O)OC3(C)C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Caryocaraceae Caryocar glabrum Fruits 0.002521% J Nat Prod 69, 196-205 (2006) 10.1021/np050336s
Properties
HBA 18 HBD 10
HeavyAtoms 65 AlogP -0.01
TPSA 283.98 RotatableBonds 10
FractionCSP3 0.98 Rings 9
AromaticRings 0 AliphaticRings 9