Compound Information | SONAR Target prediction | Name: | EUPHOL ACETATE | Unique Identifier: | SPE00100583 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | | Molecular Weight: | 416.341 g/mol | X log p: | 2.885 (online calculus) | Lipinksi Failures | 0 | TPSA | 26.3 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 2 | Rotatable Bond Count: | 6 | Canonical Smiles: | CC(CCC=C(C)C)C1CCC2(C)C3CCC4C(C)(C)C(CCC4(C)C=3CCC12C)OC(C)=O | Class: | sterol | Source: | Euphorbia spp | Reference: | Helv Chim Acta 37: 2306 (1954) |
Species: |
4932 |
Condition: |
MRT4 |
Replicates: |
2 |
Raw OD Value: r im |
0.4123±0.0121622 |
Normalized OD Score: sc h |
0.8464±0.0350499 |
Z-Score: |
-5.0160±0.422027 |
p-Value: |
0.00000124648 |
Z-Factor: |
-1.58851 |
Fitness Defect: |
13.5952 |
Bioactivity Statement: |
Active |
Experimental Conditions | | Library: | Spectrum | Plate Number and Position: | 2|D7 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 26.80 Celcius | Date: | 2007-08-30 YYYY-MM-DD | Plate CH Control (+): | 0.03949999999999999±0.00059 | Plate DMSO Control (-): | 0.46475±0.05332 | Plate Z-Factor: | 0.4602 |
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635170 |
[17-(5-ethyl-6-methyl-heptan-2-yl)-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopent a[a]phenanthren-3-yl] acetate |
636624 |
n/a |
3036237 |
[(3S,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,5,6,7,11,12,15,16,17 -decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate |
3082493 |
n/a |
3580556 |
(4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,13,14-tetradecahydropicen-3-yl) acetate |
4103050 |
(10,13-dimethyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl) acetate |
internal high similarity DBLink | Rows returned: 3 | |
nonactive | Cluster 1278 | Additional Members: 6 | Rows returned: 4 | |
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