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- ChemComp-EPR: {5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3... -
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Open data
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Basic information
Entry | ![]() | ||
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Name | Name: { Synonyms: Epalrestat Comment | inhibitor*YM | |
-Chemical information
Composition | |||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: EPR / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4JIH | ||||||
History |
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | {(OpenEye OEToolkits 1.7.6 | |
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-PDB entries
Showing all 4 items
![](data/pdb/img/4jih.jpg)
PDB-4jih:
Crystal Structure Of AKR1B10 Complexed With NADP+ And Epalrestat
![](data/pdb/img/4jir.jpg)
PDB-4jir:
Crystal Structure Of Aldose Reductase (AKR1B1) Complexed With NADP+ And Epalrestat
![](data/pdb/img/6kiy.jpg)
PDB-6kiy:
Crystal structure of a thermostable aldo-keto reductase Tm1743 in complex with inhibitor Epalrestat
![](data/pdb/img/6ky6.jpg)
PDB-6ky6:
Crystal structure of a thermostable aldo-keto reductase Tm1743 in complexs with inhibitor epalrestat in space group P3221cc