| Compound Information | SONAR Target prediction | | Name: | DIHYDROJASMONIC ACID | | Unique Identifier: | SPE01504104 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 192.127 g/mol | | X log p: | -1.077 (online calculus) | | Lipinksi Failures | 0 | | TPSA | 34.14 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 3 | | Rotatable Bond Count: | 6 | | Canonical Smiles: | CCCCCC1C(CCC1=O)CC(O)=O | | 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: |
DIA2 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.6126±0.00806102 |
| Normalized OD Score: sc h |
0.9873±0.00526306 |
| Z-Score: |
-0.5870±0.260123 |
| p-Value: |
0.563834 |
| Z-Factor: |
-12.1305 |
| Fitness Defect: |
0.573 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | SPECMTS3 | | Plate Number and Position: | 16|G10 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 25.90 Celcius | | Date: | 2008-06-18 YYYY-MM-DD | | Plate CH Control (+): | 0.040125±0.00045 | | Plate DMSO Control (-): | 0.5939±0.01667 | | Plate Z-Factor: | 0.9130 |
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ps
pdf |
| 538225 |
5-oxo-2-propyl-hexanoic acid |
| 544497 |
4-(3-hydroxy-10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanth
ren-17-yl)pentanoic acid |
| 545902 |
4,4-dimethyl-5-oxo-heptanoic acid |
| 574349 |
7a-methyl-1-(6-methylheptan-2-yl)-5-(1-methyl-2-oxo-cyclohexyl)-1,2,3,3a,4,5,6,7-octahydroindene-4-carbo
xylic acid |
| 587805 |
3-(1,3,3-trimethyl-2-oxo-cyclohexyl)propanoic acid |
| 592399 |
7a-methyl-1-oxo-3,3a,4,5,6,7-hexahydro-2H-indene-4-carboxylic acid |
| internal high similarity DBLink | Rows returned: 13 | 1 2 3 Next >> |
| active | Cluster 11884 | Additional Members: 2 | Rows returned: 1 | |
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