TPCN04028
![[object Object]](../../static/browser_molecular_png/TPCN04028.png)
| Name | Kudinoside E |
| Molecular Formula | C53H82O22 |
| Molecular Weight | 1071.22 |
| CAS Registry Number | 173792-62-6 |
| SMILES | CC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4C=CC4=C6C7(CCC(C)(OC7=O)C6(C)O)CCC45C)C3(C)C)OCC(O)C2OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Aquifoliaceae | Ilex kudincha | Leaves | 0.000133% | Planta Med 77, 1835-1840 (2011). | 10.1055/s-0030-1271164 |
Properties
| HBA | 22 | HBD | 12 |
| HeavyAtoms | 75 | AlogP | -1.32 |
| TPSA | 342.90 | RotatableBonds | 10 |
| FractionCSP3 | 0.91 | Rings | 11 |
| AromaticRings | 0 | AliphaticRings | 11 |