Compound Information | SONAR Target prediction | Name: | ERYTHROMYCIN STEARATE | Unique Identifier: | SPE01500281 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | C57H107NO15 | Molecular Weight: | 938.608 g/mol | X log p: | -2.678 (online calculus) | Lipinksi Failures | 1 | TPSA | 92.76 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 14 | Rotatable Bond Count: | 7 | Canonical Smiles: | CCCCCCCCCCCCCCCCCCCC(O)=O.CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C (OC2OC(C)CC(C2O)N(C)C)C(C)(O)CC(C)C(=O)C(C)C(O)C1(C)O | Source: | ex Streptomyces erythreus | Therapeutics: | antibacterial |
Species: |
4932 |
Condition: |
BY4741-3rd |
Replicates: |
2 |
Raw OD Value: r im |
0.7039±0.00615183 |
Normalized OD Score: sc h |
0.9990±0.000770396 |
Z-Score: |
-0.0378±0.0289945 |
p-Value: |
0.96987 |
Z-Factor: |
-71.697 |
Fitness Defect: |
0.0306 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | Spectrum | Plate Number and Position: | 20|H9 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 27.00 Celcius | Date: | 2007-09-25 YYYY-MM-DD | Plate CH Control (+): | 0.039349999999999996±0.00082 | Plate DMSO Control (-): | 0.689225±0.02235 | Plate Z-Factor: | 0.9147 |
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6540620 |
(3R,4S,5S,6R,7R,9R,11R,12R,13R,14R)-6-[(2S,3R,4S,6R)-4-dimethylamino-3-hydroxy-6-methyl-oxan-2-yl]oxy-14 -ethyl-7,12,13-trihydroxy-4-[(4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyl-oxan-2-yl]oxy-3,5,7,9,11,13-hex amethyl-1-oxacyclotetradecane-2,10-dione |
6602506 |
(3R,4S,5S,6R,7R,9R,11R,12R,13R,14R)-6-[(3R,4S,6R)-4-dimethylamino-3-hydroxy-6-methyl-oxan-2-yl]oxy-14-et hyl-7,12,13-trihydroxy-4-[(2S,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyl-oxan-2-yl]oxy-3,5,7,9,11,13-hex amethyl-1-oxacyclotetradecane-2,10-dione |
6604221 |
(3R,4R,5S,6S,7R,9S,11R,12S,13R,14S)-6-[(2S,3S,4R,6S)-4-dimethylamino-3-hydroxy-6-methyl-oxan-2-yl]oxy-14 -ethyl-7,12,13-trihydroxy-4-[(2R,4S,5R,6S)-5-hydroxy-4-methoxy-4,6-dimethyl-oxan-2-yl]oxy-3,5,7,9,11,13- hexamethyl-1-oxacyclotetradecane-2,10-dione |
6604684 |
(3S,4R,5S,6S,7S,9S,11S,12S,13S,14S)-6-[(2S,3R,4R,6S)-4-dimethylamino-3-hydroxy-6-methyl-oxan-2-yl]oxy-14 -ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyl-oxan-2-yl]oxy-3,5,7,9,11,13- hexamethyl-1-oxacyclotetradecane-2,10-dione |
6713919 |
(3R,4S,5S,6R,7R,9R,11R,12R,13R,14R)-6-[(2R,3R,4S,6R)-4-dimethylamino-3-hydroxy-6-methyl-oxan-2-yl]oxy-14 -ethyl-7,12,13-trihydroxy-4-[(2S,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyl-oxan-2-yl]oxy-3,5,7,9,11,13- hexamethyl-1-oxacyclotetradecane-2,10-dione |
15986867 |
(3R,4R,6S,7R,9S,12R,13R,14R)-6-[(2S,3R,4S,6R)-4-dimethylamino-3-hydroxy-6-methyl-oxan-2-yl]oxy-14-ethyl- 7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyl-oxan-2-yl]oxy-3,5,7,9,11,13-hexamet hyl-1-oxacyclotetradecane-2,10-dione |
internal high similarity DBLink | Rows returned: 1 | |
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