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- ChemComp-AGC: ALPHA-D-GLUCOSE -

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ID or keywords:

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Basic information

EntryDatabase: PDB chemical components / ID: AGC
Status

GLC

Status: Obsoleted / Replaced by: GLC
NameName: alpha-D-glucose

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Chemical information

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

1v2b

Type: D-SACCHARIDE / PDB classification: ATOMS / Three letter code: AGC / Model coordinates PDB-ID: 1V2B
History
Create componentOct 15, 2003
External linksUniChem / ChemSpider / 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 1.02bInChI=1/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 1.02bWQZGKKKJIJFFOK-DVKNGEFBBQ

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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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