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Yorodumi- ChemComp-52Y: methyl (2Z)-cyano[3-(3-fluoro-4'-methoxybiphenyl-4-yl)-4-oxo-1,3-... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 52Y |
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Name | Name: |
-Chemical information
Composition | Formula: C20H15FN2O4S / Number of atoms: 43 / Formula weight: 398.408 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 52Y / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4YLW | ||||
History |
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External links | UniChem / ChemSpider / PubChem / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 1.9.2 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 1.9.2 | |
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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 1.9.2 | |
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-PDB entries
Showing all 1 items
PDB-4ylw:
Crystal structure of human dihydroorotate dehydrogenase (DHODH) with No.33 compound