TPCN03874
![[object Object]](../../static/browser_molecular_png/TPCN03874.png)
| Name | Ilexoside P |
| Molecular Formula | C53H84O23 |
| Molecular Weight | 1089.23 |
| CAS Registry Number | 1412236-76-0 |
| SMILES | CC1OC(OC2C(OC3C(OC4CCC5(C)C(CCC6(C)C5CC=C5C7C(C(=O)OC8OC(CO)C(O)C(O)C8O)(CCC(C)C7(C)O)CCC56C)C4(C)C=O)OCC(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Aquifoliaceae | Ilex pubescens | Roots | 0.000420% | Nat Prod Res 27, 1343-1347 (2013). | 10.1080/14786419.2012.738208 |
Properties
| HBA | 23 | HBD | 13 |
| HeavyAtoms | 76 | AlogP | -2.22 |
| TPSA | 370.97 | RotatableBonds | 11 |
| FractionCSP3 | 0.92 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |