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Yorodumi- ChemComp-15F: 1-BENZYL-4-({[(1E)-2,2,2-TRICHLOROETHANIMIDOYL]OXY}METHYL)PYRIDINIUM -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 15F |
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Name | Name: |
-Chemical information
Composition | Formula: C15H14Cl3N2O / Number of atoms: 35 / Formula weight: 344.643 / Formal charge: 1 | ||||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: 15F / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4B0O | ||||||
History |
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External links | UniChem / ChemSpider / 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-4b0o:
Crystal structure of soman-aged human butyrylcholinesterase in complex with benzyl pyridinium-4-methyltrichloroacetimidate