TPCN03990
![[object Object]](../../static/browser_molecular_png/TPCN03990.png)
| Name | Ilexpublesnin A |
| Molecular Formula | C41H64O14 |
| Molecular Weight | 780.95 |
| CAS Registry Number | 1309354-77-5 |
| SMILES | CC1CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(C=O)C5CCC43C)C2C1(C)O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Aquifoliaceae | Ilex pubescens | Roots | 0.000190% | Fitoterapia 81, 788-792 (2010). | 10.1016/j.fitote.2010.04.008 |
| Aquifoliaceae | Ilex pubescens | Roots | 0.000110% | Fitoterapia 81, 788-792 (2010). | 10.1016/j.fitote.2010.04.008 |
Properties
| HBA | 14 | HBD | 8 |
| HeavyAtoms | 55 | AlogP | 1.11 |
| TPSA | 232.90 | RotatableBonds | 6 |
| FractionCSP3 | 0.90 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |