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: |
MKK1 |
Replicates: |
2 |
Raw OD Value: r im |
0.8190±0.039598 |
Normalized OD Score: sc h |
0.9772±0.0228006 |
Z-Score: |
-0.6330±0.615203 |
p-Value: |
0.564282 |
Z-Factor: |
-4.92809 |
Fitness Defect: |
0.5722 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | Spectrum_ED | Plate Number and Position: | 22|A8 | Drug Concentration: | 50.00 nM | OD Absorbance: | 595 nm | Robot Temperature: | 30.00 Celcius | Date: | 2010-08-10 YYYY-MM-DD | Plate CH Control (+): | 0.09075±0.00752 | Plate DMSO Control (-): | 0.9630000000000001±0.02354 | Plate Z-Factor: | 0.9097 |
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170615 |
methyl 2-(3-oxo-2-propyl-cyclopentyl)acetate |
226643 |
methyl 4-oxocyclohexane-1-carboxylate |
226672 |
methyl 3-[1,3,3-tris(2-methoxycarbonylethyl)-2-oxo-cyclohexyl]propanoate |
250425 |
n/a |
289583 |
methyl 3-[3-(2-methoxycarbonylethyl)-2-oxo-cyclohexyl]propanoate |
348027 |
methyl 2-(2-acetyl-2,4b,6a,9,9,10b,12a-heptamethyl-1,3,4,4a,5,6,7,8,10,10a,11,12-dodecahydrochrysen-1-yl)acetat e |
internal high similarity DBLink | Rows returned: 11 | 1 2 Next >> |
active | Cluster 11884 | Additional Members: 2 | Rows returned: 0 | |
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