Compound Information | SONAR Target prediction | Name: | EPIGALLOCATECHIN OCTAMETHYL ETHER | Unique Identifier: | SPE00211477 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | C30H34O11 | Molecular Weight: | 536.314 g/mol | X log p: | 16.175 (online calculus) | Lipinksi Failures | 3 | TPSA | 109.37 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 11 | Rotatable Bond Count: | 12 | Canonical Smiles: | COc1cc(OC)c2CC(OC(=O)c3cc(OC)c(OC)c(OC)c3)C(Oc2c1)c1cc(OC)c(OC)c(OC)c1 | Source: | derivative ex green tea |
Species: |
4932 |
Condition: |
IRE1 |
Replicates: |
2 |
Raw OD Value: r im |
0.7176±0.0019799 |
Normalized OD Score: sc h |
0.9997±0.00216556 |
Z-Score: |
-0.0119±0.116062 |
p-Value: |
0.934598 |
Z-Factor: |
-8.08386 |
Fitness Defect: |
0.0676 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | Spectrum | Plate Number and Position: | 21|E9 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 23.90 Celcius | Date: | 2007-11-23 YYYY-MM-DD | Plate CH Control (+): | 0.040625±0.00083 | Plate DMSO Control (-): | 0.7050749999999999±0.15570 | Plate Z-Factor: | 0.2145 |
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DBLink | Rows returned: 2 | |
3598211 |
[5,7-dimethoxy-2-(3,4,5-trimethoxyphenyl)chroman-3-yl] 3,4,5-trimethoxybenzoate |
6708757 |
[(2R,3R)-5,7-dimethoxy-2-(3,4,5-trimethoxyphenyl)chroman-3-yl] 3,4,5-trimethoxybenzoate |
internal high similarity DBLink | Rows returned: 4 | |
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