Compound Information | SONAR Target prediction | Name: | URSOLIC ACID | Unique Identifier: | SPE01800031 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | | Molecular Weight: | 408.319 g/mol | X log p: | 1.367 (online calculus) | Lipinksi Failures | 0 | TPSA | 17.07 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 3 | Rotatable Bond Count: | 1 | Canonical Smiles: | CC1CCC2(CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1C)C(O)=O | Class: | triterpene | Source: | Rhododendron spp, Epigaea asiatica, surface wax of fruits | Reference: | Phytochemistry 10:3279 (1971) | Therapeutics: | diuretic, antineoplastic, antiulcer |
Species: |
4932 |
Condition: |
APC9 |
Replicates: |
2 |
Raw OD Value: r im |
0.6870±0.0026163 |
Normalized OD Score: sc h |
0.9874±0.00632906 |
Z-Score: |
-0.6893±0.354226 |
p-Value: |
0.504064 |
Z-Factor: |
-11.2361 |
Fitness Defect: |
0.6851 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | Spectrum | Plate Number and Position: | 5|F6 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 21.70 Celcius | Date: | 2007-11-22 YYYY-MM-DD | Plate CH Control (+): | 0.041374999999999995±0.00052 | Plate DMSO Control (-): | 0.687425±0.02326 | Plate Z-Factor: | 0.8902 |
| png ps pdf |
7067299 |
(4aS,6aS,6aR,6bS,8aS,10S,12aS,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,1 2,13,14b-tetradecahydropicene-4a-carboxylate |
7067300 |
(4aS,6aS,6aR,6bS,8aS,10S,12aS,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,1 2,13,14b-tetradecahydropicene-4a-carboxylic acid |
7067301 |
(4aR,6aS,6aR,6bS,8aS,10S,12aS,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,1 2,13,14b-tetradecahydropicene-4a-carboxylate |
7067302 |
(4aR,6aS,6aR,6bS,8aS,10S,12aS,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,1 2,13,14b-tetradecahydropicene-4a-carboxylic acid |
7067303 |
(4aS,6aR,6aR,6bS,8aS,10S,12aS,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,1 2,13,14b-tetradecahydropicene-4a-carboxylate |
7067304 |
(4aS,6aR,6aR,6bS,8aS,10S,12aS,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,1 2,13,14b-tetradecahydropicene-4a-carboxylic acid |
internal high similarity DBLink | Rows returned: 8 | 1 2 Next >> |
active | Cluster 1869 | Additional Members: 9 | Rows returned: 3 | |
|