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 |