TPCN05717
Name | 3-O-??-D-galactopyranosyl-(1??2)-??-D-glucuronopyranosyl-gypsogenin-28-O-??-D-xylopyranosyl-(1??3)-??-D-xylopyranosyl-(1??4)-??-L-rhamnopyranosyl-(1??2)-??-L-arabinopyranoside |
Molecular Formula | C63H98O31 |
Molecular Weight | 1351.45 |
CAS Registry Number | 2271390-42-0 |
SMILES | CC1OC(OC2C(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CCC(OC7OC(C(=O)O)C(O)C(O)C7OC7OC(CO)C(O)C(O)C7O)C(C)(C=O)C6CCC5(C)C3(C)CC4)OCC(O)C2O)C(O)C(O)C1OC1OCC(O)C(OC2OCC(O)C(O)C2O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Papaveraceae | Hylomecon japonica | Whole plants | 0.002500% | Molecules. 2017 Oct 23;22(10). pii: molecules22101731. | 10.3390/molecules22101731. |
Properties
HBA | 31 | HBD | 16 |
HeavyAtoms | 94 | AlogP | -4.17 |
TPSA | 485.65 | RotatableBonds | 15 |
FractionCSP3 | 0.92 | Rings | 11 |
AromaticRings | 0 | AliphaticRings | 11 |