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Yorodumi- ChemComp-HQ9: 2-(6-oxidanyl-3-oxidanylidene-cyclohexa-1,4-dien-1-yl)ethanoic acid -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: HQ9 |
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Name | Name: |
-Chemical information
Composition | Formula: C8H8O4 / Number of atoms: 20 / Formula weight: 168.147 / Formal charge: 0 | ||||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: HQ9 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3ZDS | ||||||
History |
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External links | UniChem / ChemSpider / PubChem / ZINC / 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-3zds:
Structure of homogentisate 1,2-dioxygenase in complex with reaction intermediates of homogentisate with oxygen.