+Open data
-Basic information
Entry | Database: PDB chemical components / ID: NEF |
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Name | Name: Synonyms: (2R)-5-[(E)-2-(2,4-dinitrophenyl)ethenyl]-2-[(1R)-2-oxidanyl-2-oxidanylidene-1-(2-thiophen-2-ylethanoylamino)ethyl]-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid |
-Chemical information
Composition | Formula: C21H18N4O9S2 / Number of atoms: 54 / Formula weight: 534.519 / Formal charge: 0 | ||||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: NEF / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6HR9 | ||||||||||
History |
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External links | UniChem / Brenda / PubChem / ChemSpider / 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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