TPCN05562
![[object Object]](../../static/browser_molecular_png/TPCN05562.png)
| Name | Symplocososides R |
| Molecular Formula | C57H90O19 |
| Molecular Weight | 1079.33 |
| CAS Registry Number | 918300-75-1 |
| SMILES | CCC(C)C(=O)OC1C(OC(=O)C=C(C)CCC=C(C)C)C(C)(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)C(O)C(O)C21CO |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Symplocaceae | Symplocos chinensis | Roots | 0.000145% | J Nat Prod. 2006. 69, 1680-1686. | 10.1021/np060160+. |
Properties
| HBA | 19 | HBD | 10 |
| HeavyAtoms | 76 | AlogP | 3.61 |
| TPSA | 308.89 | RotatableBonds | 15 |
| FractionCSP3 | 0.84 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |