+Open data
-Basic information
Entry | Database: PDB chemical components / ID: HQ8 | ||
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Name | Name: (Wikipedia | Wikipedia - 5-Deoxyinositol: 5-Deoxyinositol is a cyclitol. It can be found in wines aged in oak wood barrels. It can also be found in Quercus sp. (oaks) and in Gymnema sylvestre. It is different from quercetol, a synonym of quercetin.
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-Chemical information
Composition | Formula: C6H12O5 / Number of atoms: 23 / Formula weight: 164.156 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: HQ8 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6Q8N | ||||
History |
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External links | UniChem / Brenda / ChEBI / ChEMBL / CompTox / KEGG_Ligand / NMRShiftDB / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-PDB entries
Showing all 1 items
PDB-6q8n:
GH10 endo-xylanase in complex with xylobiose epoxide inhibitor