SHG

2-deoxy-2-fluoro-beta-D-glucopyranose

Created:	2009-01-17
Last modified:	2024-09-27

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4 entries where SHG is found as a standalone ligand1 entries where SHG is covalently linked to polymer or other heterogen groups 4 entries where SHG is found in a branched oligosaccharide

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Chemical Details
Formal Charge	0
Atom Count	23
Chiral Atom Count	5
Bond Count	23
Aromatic Bond Count	0

2D diagram of SHG

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Chemical Component Summary
Name	2-deoxy-2-fluoro-beta-D-glucopyranose
Synonyms	2-deoxy-2-fluoro-beta-D-glucose; 2-deoxy-2-fluoro-D-glucose; 2-deoxy-2-fluoro-glucose
Systematic Name (OpenEye OEToolkits)	(2R,3R,4S,5S,6R)-3-fluoranyl-6-(hydroxymethyl)oxane-2,4,5-triol
Formula	C₆ H₁₁ F O₅
Molecular Weight	182.147
Type	D-SACCHARIDE, BETA LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	FC1C(O)C(O)C(OC1O)CO
SMILES	CACTVS	3.385	OC[CH]1O[CH](O)[CH](F)[CH](O)[CH]1O
SMILES	OpenEye OEToolkits	1.7.6	C(C1C(C(C(C(O1)O)F)O)O)O
Canonical SMILES	CACTVS	3.385	OC[C@H]1O[C@@H](O)[C@H](F)[C@@H](O)[C@@H]1O
Canonical SMILES	OpenEye OEToolkits	1.7.6	C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O)F)O)O)O
InChI	InChI	1.03	InChI=1S/C6H11FO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1H2/t2-,3-,4-,5-,6-/m1/s1
InChIKey	InChI	1.03	ZCXUVYAZINUVJD-QZABAPFNSA-N

Related Resource References

Resource Name	Reference
PubChem	5288324
ChEMBL	CHEMBL1235932
ChEBI	CHEBI:49128

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