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Yorodumi- ChemComp-JU0: (2~{R},3~{R},4~{S},5~{R},6~{R})-2-(5-bromanylpyridin-3-yl)sulfany... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: JU0 |
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Name | Name: ( Synonyms: 5-Bromopyridin-3-yl 3-deoxy-3-[4-(3,4,5-trifluorophenyl)-1H-1,2,3-triazol-1-yl]-1-thio-alpha-D-galactopyranoside |
-Chemical information
Composition | Formula: C19H16BrF3N4O4S / Number of atoms: 48 / Formula weight: 533.319 / Formal charge: 0 | ||||||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: JU0 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7ZQX | ||||||||
History |
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External links | UniChem / ChemSpider / ChEMBL / PubChem / SureChEMBL / 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 1.06 |
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-InChIKey
InChI 1.06 |
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-PDB entries
Showing all 1 items
PDB-7zqx:
Human galectin-3c in complex with a galactose derivative