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- ChemComp-GL0: beta-D-gulopyranose -

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Basic information

EntryDatabase: PDB chemical components / ID: GL0
NameName: beta-D-gulopyranose / Synonyms: beta-D-gulose; D-gulose; gulose

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Chemical information

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

2obs

Type: D-saccharide, beta linking / PDB classification: ATOMS / Three letter code: GL0 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 2OBS
History
Create componentMar 25, 2008
Modify descriptorJun 4, 2011
Other modificationAug 2, 2011
Other modificationAug 12, 2019
Modify leaving atom flagSep 17, 2019
Other modificationDec 19, 2019
Other modificationJul 3, 2020
Modify synonymsJul 17, 2020
Modify component atom idJul 17, 2020
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 12.01OC1C(O)C(OC(O)C1O)CO
CACTVS 3.370OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
OpenEye OEToolkits 1.7.2C(C1C(C(C(C(O1)O)O)O)O)O

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SMILES CANONICAL

CACTVS 3.370OC[C@H]1O[C@@H](O)[C@H](O)[C@H](O)[C@H]1O
OpenEye OEToolkits 1.7.2C([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-AIECOIEWSA-N

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SYSTEMATIC NAME

ACDLabs 12.01beta-D-gulopyranose
OpenEye OEToolkits 1.7.2(2R,3R,4R,5R,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol

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CONDENSED IUPAC CARBOHYDRATE SYMBOL

GMML 1.0DGulpb

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COMMON NAME

GMML 1.0b-D-gulopyranose

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IUPAC CARBOHYDRATE SYMBOL

PDB-CARE 1.0b-D-Gulp

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SNFG CARBOHYDRATE SYMBOL

GMML 1.0Gul

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