| Compound Information | SONAR Target prediction |
| Name: | DIOSGENIN |
| Unique Identifier: | SPE00100318 |
| MolClass: | Checkout models in ver1.5 and ver1.0 |
| Molecular Formula: | |
| Molecular Weight: | 372.287 g/mol |
| X log p: | 1.805 (online calculus) |
| Lipinksi Failures | 0 |
| TPSA | 18.46 |
| Hydrogen Bond Donor Count: | 0 |
| Hydrogen Bond Acceptors Count: | 3 |
| Rotatable Bond Count: | 0 |
| Canonical Smiles: | CC1CCC2(OC1)OC1CC3C4CC=C5CC(O)CCC5(C)C4CCC3(C)C1C2C |
| Class: | sterol |
| Source: | Clintonia, Dioscorea and Solanum spp, Trillium erectum, Balanites aegyptiaca, Aletris farinos |
| Reference: | Konstitution und Vorkommen der Organischen Pflanzenstoffe,2nd edn, # 2095 (1972); Anal Profiles Drug Subst 23:99 (1994) |
| Therapeutics: | antiinflammatory, estrogen; LD50(rat) 4872 mg/kg ip. LD50 (mouse) >8000 mg/kg po |
| Found: 205 nonactive as graph: single | with analogs | [1] << Back 191 192 193 194 195 196 197 198 199 200 Next >> [205] |
| Species: | 4932 |
| Condition: | SWR1 |
| Replicates: | 2 |
| Raw OD Value: r im | 0.6683±0.00933381 |
| Normalized OD Score: sc h | 1.0085±0.0197904 |
| Z-Score: | 0.3402±0.806242 |
| p-Value: | 0.590412 |
| Z-Factor: | -29.4231 |
| Fitness Defect: | 0.5269 |
| Bioactivity Statement: | Nonactive |
| ps |
| DBLink | Rows returned: 21 | 1 2 3 4 Next >> |
| 10536 |
| 99474 |
| 135760 |
| 234096 |
| 441900 |
| 3742216 |
| internal high similarity DBLink | Rows returned: 1 |
| SPE00100305 | 0.9545 |
| nonactive | Cluster 10789 | Additional Members: 6 | Rows returned: 4 |
| SPE01504607 | 0.584158415841584 |
| LAT005E11 | 0.340909090909091 |
| Prest1042 | 0 |
| SPE00100537 | 0 |
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