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- ChemComp-GLC: alpha-D-glucopyranose -

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Open data


ID or keywords:

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Basic information

EntryDatabase: PDB chemical components / ID: GLC
NameName: alpha-D-glucopyranose / Synonyms: alpha-D-glucose; D-glucose; glucose

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Chemical information

Composition
Formula: C6H12O6 / Number of atoms: 24 / Formula weight: 180.156 / Formal charge: 0
Others

1anf

AGC

Type: D-saccharide, alpha linking / PDB classification: ATOMS / Three letter code: GLC / Ideal coordinates details: Corina / Model coordinates PDB-ID: 1ANF / Replaces: AGC
History
Create componentJul 8, 1999
Modify descriptorJun 4, 2011
Other modificationAug 12, 2019
Other modificationDec 19, 2019
Other modificationJul 3, 2020
Modify nameJul 17, 2020
Modify synonymsJul 17, 2020
External linksUniChem / ChemSpider / BindingDB / Brenda / ChEBI / ChEMBL / ChemicalBook / CompTox / HMDB / KEGG_Ligand / Metabolights / NMRShiftDB / Nikkaji / PubChem / PubChem_TPharma / Rhea / SureChEMBL / ZINC / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

ACDLabs 10.04OC1C(O)C(OC(O)C1O)CO
CACTVS 3.341OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
OpenEye OEToolkits 1.5.0C(C1C(C(C(C(O1)O)O)O)O)O

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SMILES CANONICAL

CACTVS 3.341OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O
OpenEye OEToolkits 1.5.0C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O)O)O)O)O

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InChI

InChI 1.03InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1

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InChIKey

InChI 1.03WQZGKKKJIJFFOK-DVKNGEFBSA-N

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SYSTEMATIC NAME

ACDLabs 10.04alpha-D-glucopyranose
OpenEye OEToolkits 1.5.0(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol

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CONDENSED IUPAC CARBOHYDRATE SYMBOL

GMML 1.0DGlcpa

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COMMON NAME

GMML 1.0a-D-glucopyranose

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IUPAC CARBOHYDRATE SYMBOL

PDB-CARE 1.0a-D-Glcp

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SNFG CARBOHYDRATE SYMBOL

GMML 1.0Glc

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PDB entries

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