TPCN03555
![[object Object]](../../static/browser_molecular_png/TPCN03555.png)
| Name | Vitalboside B |
| Molecular Formula | C60H98O28 |
| Molecular Weight | 1267.42 |
| CAS Registry Number | 244776-21-4 |
| SMILES | CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CCC(C)(C)CC4C4=CCC6C7(C)CCC(OC8OC(CO)C(O)C(O)C8OC8OC(CO)C(O)C(O)C8O)C(C)(CO)C7CCC6(C)C4(C)CC5)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Lamiaceae | Elsholtzia bodinieri | Aerial parts | 0.002667% | Nat Prod Res, 2020, 1-9. | 10.1080/14786419.2020.1721489 |
Properties
| HBA | 28 | HBD | 17 |
| HeavyAtoms | 88 | AlogP | -4.21 |
| TPSA | 453.28 | RotatableBonds | 15 |
| FractionCSP3 | 0.95 | Rings | 10 |
| AromaticRings | 0 | AliphaticRings | 10 |