TPCN04858
![[object Object]](../../static/browser_molecular_png/TPCN04858.png)
| Name | Phyteumosides A |
| Molecular Formula | C50H84O20 |
| Molecular Weight | 1005.20 |
| CAS Registry Number | 1270009-05-6 |
| SMILES | CC(=O)OC1CC2C(C)(CCC(O)C2(C)C)OC1(C)C1CCC2C(C)(CCC3C(C)(C)C(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4OC4OC(C)C(O)C(O)C4O)CCC23C)O1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Campanulaceae | Phyteuma orbiculare | Aerial parts | 0.022566% | Org Lett 13, 1354-1357 (2011) | 10.1021/ol200047v |
Properties
| HBA | 20 | HBD | 10 |
| HeavyAtoms | 70 | AlogP | 0.30 |
| TPSA | 302.44 | RotatableBonds | 10 |
| FractionCSP3 | 0.98 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |