Compound Information | SONAR Target prediction | Name: | DIHYDROJASMONIC ACID, METHYL ESTER | Unique Identifier: | SPE01504910 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | | Molecular Weight: | 204.137 g/mol | X log p: | -0.243 (online calculus) | Lipinksi Failures | 0 | TPSA | 43.37 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 3 | Rotatable Bond Count: | 7 | Canonical Smiles: | CCCCCC1C(CCC1=O)CC(=O)OC | Class: | alkane | Source: | Jasminium spp and Vicia faba | Reference: | Helv Chim Acta 57: 1301 (1974); Tet Lett 3413 (1974); JACS 97: 6144 (1975); PNAS 98: 4788 (2001) | Therapeutics: | plant growth regulator |
Species: |
4932 |
Condition: |
CKA2 |
Replicates: |
2 |
Raw OD Value: r im |
0.8121±0.0013435 |
Normalized OD Score: sc h |
0.9903±0.00175051 |
Z-Score: |
-0.3488±0.0469378 |
p-Value: |
0.727402 |
Z-Factor: |
-9.24329 |
Fitness Defect: |
0.3183 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | Spectrum | Plate Number and Position: | 6|H9 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 25.30 Celcius | Date: | 2006-04-03 YYYY-MM-DD | Plate CH Control (+): | 0.038525±0.00169 | Plate DMSO Control (-): | 0.808125±0.01498 | Plate Z-Factor: | 0.9351 |
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3483658 |
methyl 5-oxooctadecanoate |
3721234 |
n/a |
4078246 |
methyl 4-oxoadamantane-1-carboxylate |
4131262 |
methyl 2-(10,13-dimethyl-3,12-dioxo-2,4,5,6,7,8,9,11,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl) propanoate |
4396296 |
methyl 10,13-dimethyl-3,11-dioxo-2,4,5,6,7,8,9,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-17-carbo xylate |
5094585 |
methyl 5-oxohexadecanoate |
internal high similarity DBLink | Rows returned: 11 | << Back 1 2 |
active | Cluster 11884 | Additional Members: 2 | Rows returned: 0 | |
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