TPCN05288
![[object Object]](../../static/browser_molecular_png/TPCN05288.png)
| Name | ??-sitosterol |
| Molecular Formula | C58H94O26 |
| Molecular Weight | 1207.36 |
| CAS Registry Number | 1256561-68-8 |
| SMILES | CC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CC=C4C6CC(C)(C)CCC6(C(=O)OC6OC(CO)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)CCC45C)C3(C)CO)OCC(O)C2O)C(O)C(OC2OCC(O)C(O)C2O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Amaranthaceae | Chenopodium ficifolium | Aerial parts | 0.008471% | Z Naturforsch C J Biosci. 2002. 57, 597-602. | 10.1080/14786410903230383. |
Properties
| HBA | 26 | HBD | 15 |
| HeavyAtoms | 84 | AlogP | -2.93 |
| TPSA | 412.82 | RotatableBonds | 13 |
| FractionCSP3 | 0.95 | Rings | 10 |
| AromaticRings | 0 | AliphaticRings | 10 |