TPCN05568
Name | 3??-O-{??-D-ribopyranosyl-(1??3)-??-L-rhamnopyranosyl-(1??2)-[??-D-glucopyranosyl-(1??4)]-??-D-xylopyranosyl} oleanolic acid |
Molecular Formula | C52H84O20 |
Molecular Weight | 1029.22 |
CAS Registry Number | 1422173-15-6 |
SMILES | CC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CC=C4C6CC(C)(C)CCC6(C(=O)O)CCC45C)C3(C)C)OCC(OC3OC(CO)C(O)C(O)C3O)C2O)C(O)C(OC2OCC(O)C(O)C2O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Ranunculaceae | Clematis argentilucida | Roots | 0.000142% | Fitoterapia. 2012. 83, 759-764. | 10.1016/j.fitote.2012.03.003 |
Properties
HBA | 20 | HBD | 11 |
HeavyAtoms | 72 | AlogP | 0.84 |
TPSA | 313.44 | RotatableBonds | 10 |
FractionCSP3 | 0.94 | Rings | 9 |
AromaticRings | 0 | AliphaticRings | 9 |