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Yorodumi- ChemComp-O8H: 4-iodo-N-[(1-{2-oxo-2-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)pi... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: O8H |
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Name | Name: |
-Chemical information
Composition | Formula: C22H22IN7O4S2 / Number of atoms: 58 / Formula weight: 639.489 / Formal charge: 0 | ||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: O8H / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3O8H | ||||||||
History |
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External links | UniChem / ChemSpider / BindingDB / ChEMBL / PubChem / SureChEMBL / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
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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 1.7.0 | |
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-PDB entries
Showing all 1 items
PDB-3o8h:
EthR from Mycobacterium tuberculosis in complex with compound BDM14950