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Yorodumi- ChemComp-J5E: (2~{R},3~{R},4~{S},5~{R},6~{S})-4-[4-[3,4-bis(fluoranyl)phenyl]-1... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: J5E |
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Name | Name: ( |
-Chemical information
Composition | Formula: C21H21F2N3O4S / Number of atoms: 52 / Formula weight: 449.471 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: J5E / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6QLO | ||||
History |
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External links | UniChem / ChemSpider / BindingDB / ChEMBL / PubChem / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-PDB entries
Showing all 1 items
PDB-6qlo:
Galectin-3C in complex with substituted fluoroaryltriazole monothiogalactoside derivative 1