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: |
BRE1 |
Replicates: |
2 |
Raw OD Value: r im |
0.4710±0.0298399 |
Normalized OD Score: sc h |
0.9918±0.0269985 |
Z-Score: |
-0.1372±0.481969 |
p-Value: |
0.735654 |
Z-Factor: |
-20.2833 |
Fitness Defect: |
0.307 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | Spectrum | Plate Number and Position: | 6|H9 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 24.70 Celcius | Date: | 2006-03-16 YYYY-MM-DD | Plate CH Control (+): | 0.039275000000000004±0.00155 | Plate DMSO Control (-): | 0.5088±0.02059 | Plate Z-Factor: | 0.8530 |
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1738125 |
methyl 2-[(1S,2S)-3-oxo-2-pentyl-cyclopentyl]acetate |
1738127 |
methyl 2-[(1S,2R)-3-oxo-2-pentyl-cyclopentyl]acetate |
2380530 |
methyl (3S,5R)-4-oxoadamantane-1-carboxylate |
2750596 |
methyl 3-acetyl-2,2,3-trimethyl-cyclopentane-1-carboxylate |
3085815 |
methyl (3S)-3-[(1S)-2-oxocyclopentyl]heptanoate |
3322754 |
methyl 3-(3-methyl-2-oxo-cyclohexyl)propanoate |
internal high similarity DBLink | Rows returned: 11 | 1 2 Next >> |
active | Cluster 11884 | Additional Members: 2 | Rows returned: 0 | |
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