Compound Information | SONAR Target prediction | Name: | Nystatin | Unique Identifier: | LAT005H11 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | C47H75NO17 | Molecular Weight: | 850.499 g/mol | X log p: | 18.921 (online calculus) | Lipinksi Failures | 2 | TPSA | 71.06 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 18 | Rotatable Bond Count: | 3 | Canonical Smiles: | CC1OC(=O)CC(O)CC(O)CC(O)CCC(O)C(O)CC2(O)CC(O)C(C(CC(OC3OC(C)C(O)C(N)C3 O)C=CC=CC=CC=CCCC=CC=CC(C)C(O)C1C)O2)C(O)=O |
Species: |
4932 |
Condition: |
pdr18h |
Replicates: |
2 |
Raw OD Value: r im |
0.0443±0.000353553 |
Normalized OD Score: sc h |
0.0706±0.00232965 |
Z-Score: |
-26.1428±2.04172 |
p-Value: |
0 |
Z-Factor: |
0.898341 |
Fitness Defect: |
INF |
Bioactivity Statement: |
Toxic |
Experimental Conditions | | Library: | LATCA | Plate Number and Position: | 5|H11 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 25.30 Celcius | Date: | 2007-03-08 YYYY-MM-DD | Plate CH Control (+): | 0.03955±0.00176 | Plate DMSO Control (-): | 0.609±0.01750 | Plate Z-Factor: | 0.8850 |
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4568 |
33-(4-amino-3,5-dihydroxy-6-methyl-oxan-2-yl)oxy-1,3,4,7,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-ox o-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,25,27,29,31-hexaene-36-carboxylic acid |
443663 |
(1S,3R,4R,7R,9R,11R,15S,16S,17R,18S,33R,35S,36S,37S)-33-[(2S,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyl -oxan-2-yl]oxy-1,3,4,7,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatr iaconta-19,21,25,27,29,31-hexaene-36-carboxylic acid |
5311331 |
(19E,21E,25E,27E,29E,31E)-33-[(2S,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyl-oxan-2-yl]oxy-1,3,4,7,9,11 ,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,25,27,29,31-h exaene-36-carboxylic acid |
5702099 |
(1S,15S,17R,18S,19E,21E,25E,27E,29E,31E)-33-[(3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyl-oxan-2-yl]oxy- 1,3,4,7,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,2 5,27,29,31-hexaene-36-carboxylic acid |
6420032 |
(1S,15S,16S,17R,18S,19E,21E,25E,27E,29E,31E)-33-(4-amino-3,5-dihydroxy-6-methyl-oxan-2-yl)oxy-1,3,4,7,9, 11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,25,27,29,31 -hexaene-36-carboxylic acid |
6433272 |
(1S,15S,16S,17R,18S,19E,21E,25E,27E,29E,31E)-33-[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyl-oxan-2- yl]oxy-1,3,4,7,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta- 19,21,25,27,29,31-hexaene-36-carboxylic acid |
internal high similarity DBLink | Rows returned: 1 | |
active | Cluster 7118 | Additional Members: 11 | Rows returned: 5 | |
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