beta-D-glucose 6-phosphate (CHEBI:17719)

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CHEBI:17719 - β-D-glucose 6-phosphate

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ChEBI Name	β-D-glucose 6-phosphate

ChEBI ID	CHEBI:17719

ChEBI ASCII Name	beta-D-glucose 6-phosphate

Definition	A D-glucopyranose 6-phosphate in which the anomeric centre has β-configuration.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:42755, CHEBI:41041, CHEBI:10399, CHEBI:12375, CHEBI:22797

Supplier Information	ZINC000003875374

Download	Molfile XML SDF

more structures >>

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29 29 0 0 0 0 999 V2000

1.9860 -0.5134 -0.1568 C 0 0 2 0 0 0 0 0 0 0 0 0

2.1024 -2.0007 -0.4974 C 0 0 1 0 0 0 0 0 0 0 0 0

3.1093 -0.1178 0.6338 O 0 0 0 0 0 0 0 0 0 0 0 0

0.7851 -0.2785 0.5752 O 0 0 0 0 0 0 0 0 0 0 0 0

0.9127 -2.4061 -1.3740 C 0 0 2 0 0 0 0 0 0 0 0 0

3.3208 -2.2358 -1.2056 O 0 0 0 0 0 0 0 0 0 0 0 0

-0.3815 -1.9996 -0.6609 C 0 0 1 0 0 0 0 0 0 0 0 0

0.9240 -3.8195 -1.5790 O 0 0 0 0 0 0 0 0 0 0 0 0

-0.3104 -0.5125 -0.3059 C 0 0 1 0 0 0 0 0 0 0 0 0

-1.4975 -2.2338 -1.5217 O 0 0 0 0 0 0 0 0 0 0 0 0

-1.6119 -0.0914 0.3755 C 0 0 0 0 0 0 0 0 0 0 0 0

-1.5508 1.2982 0.7012 O 0 0 0 0 0 0 0 0 0 0 0 0

-2.9458 1.6717 1.4129 P 0 0 1 0 0 0 0 0 0 0 0 0

-2.9458 3.2320 1.8087 O 0 0 0 0 0 0 0 0 0 0 0 0

-4.1613 1.3756 0.4007 O 0 0 0 0 0 0 0 0 0 0 0 0

-3.1115 0.8529 2.6347 O 0 0 0 0 0 0 0 0 0 0 0 0

1.9688 0.0687 -1.0776 H 0 0 0 0 0 0 0 0 0 0 0 0

2.0950 -2.5884 0.4208 H 0 0 0 0 0 0 0 0 0 0 0 0

2.9994 0.8237 0.8249 H 0 0 0 0 0 0 0 0 0 0 0 0

0.9759 -1.8977 -2.3355 H 0 0 0 0 0 0 0 0 0 0 0 0

4.0409 -1.9670 -0.6199 H 0 0 0 0 0 0 0 0 0 0 0 0

-0.4955 -2.5864 0.2504 H 0 0 0 0 0 0 0 0 0 0 0 0

1.7533 -4.0306 -2.0294 H 0 0 0 0 0 0 0 0 0 0 0 0

-0.1736 0.0706 -1.2172 H 0 0 0 0 0 0 0 0 0 0 0 0

-1.5053 -3.1798 -1.7203 H 0 0 0 0 0 0 0 0 0 0 0 0

-2.4507 -0.2708 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0

-1.7487 -0.6722 1.2883 H 0 0 0 0 0 0 0 0 0 0 0 0

-3.7970 3.4125 2.2316 H 0 0 0 0 0 0 0 0 0 0 0 0

-4.0159 1.9270 -0.3797 H 0 0 0 0 0 0 0 0 0 0 0 0

1 2 1 0 0 0 0

1 3 1 0 0 0 0

1 4 1 0 0 0 0

1 17 1 0 0 0 0

2 5 1 0 0 0 0

2 6 1 0 0 0 0

2 18 1 0 0 0 0

3 19 1 0 0 0 0

4 9 1 0 0 0 0

5 7 1 0 0 0 0

5 8 1 0 0 0 0

5 20 1 0 0 0 0

6 21 1 0 0 0 0

7 9 1 0 0 0 0

7 10 1 0 0 0 0

7 22 1 0 0 0 0

8 23 1 0 0 0 0

9 11 1 0 0 0 0

9 24 1 0 0 0 0

10 25 1 0 0 0 0

11 12 1 0 0 0 0

11 26 1 0 0 0 0

11 27 1 0 0 0 0

12 13 1 0 0 0 0

13 14 1 0 0 0 0

13 15 1 0 0 0 0

13 16 2 0 0 0 0

14 28 1 0 0 0 0

15 29 1 0 0 0 0

M END): 19 ms

reading 29 atoms

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Default Van der Waals type for model set to Babel

29 atoms created

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Formula

C6H13O9P

Net Charge

Average Mass

260.13578

Monoisotopic Mass

260.02972

InChI

InChI=1S/C6H13O9P/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1

InChIKey

NBSCHQHZLSJFNQ-VFUOTHLCSA-N

SMILES

O[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H](O)[C@H]1O

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Source: BioModels - MODEL1507180067 See: PubMed

Roles Classification
Biological Role(s):	mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). epitope The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds. fundamental metabolite Any metabolite produced by all living cells. (via D-glucose 6-phosphate )

View more via ChEBI Ontology

ChEBI Ontology
Outgoing	β-D-glucose 6-phosphate (CHEBI:17719) has functional parent β-D-glucose (CHEBI:15903) β-D-glucose 6-phosphate (CHEBI:17719) has role epitope (CHEBI:53000) β-D-glucose 6-phosphate (CHEBI:17719) has role mouse metabolite (CHEBI:75771) β-D-glucose 6-phosphate (CHEBI:17719) is a D-glucopyranose 6-phosphate (CHEBI:4170) β-D-glucose 6-phosphate (CHEBI:17719) is conjugate acid of β-D-glucose 6-phosphate(2−) (CHEBI:58247)

Incoming	β-D-glucose 6-phosphate(2−) (CHEBI:58247) is conjugate base of β-D-glucose 6-phosphate (CHEBI:17719)

IUPAC Name

β-D-glucopyranose 6-(dihydrogen phosphate)

Synonyms	Sources
6-H2PO3Glcβ	ChEBI
6-O-phosphono-β-D-glucopyranose	IUPAC
beta-D-glucose 6-(dihydrogen phosphate)	HMDB
beta-D-Glucose 6-phosphate	KEGG COMPOUND
beta-D-Glucose 6-phosphic acid	HMDB
BETA-D-GLUCOSE-6-PHOSPHATE	PDBeChem

Manual Xrefs	Databases
BG6	PDBeChem
C01172	KEGG COMPOUND
DB04122	DrugBank
GLC-6-P	MetaCyc
HMDB0003498	HMDB
View more database links

Registry Numbers	Types	Sources
1914853	Beilstein Registry Number	Beilstein
1914853	Reaxys Registry Number	Reaxys

Citations

Jandus P, Boligan KF, Smith DF, de Graauw E, Grimbacher B, Jandus C, Abdelhafez MM, Despont A, Bovin N, Simon D, Rieben R, Simon HU, Cummings RD, von Gunten S (2019)
The architecture of the IgG anti-carbohydrate repertoire in primary antibody deficiencies.
Blood 134, 1941-1950 [PubMed:31537530]
[show Abstract]

von Gunten S, Smith DF, Cummings RD, Riedel S, Miescher S, Schaub A, Hamilton RG, Bochner BS (2009)
Intravenous immunoglobulin contains a broad repertoire of anticarbohydrate antibodies that is not restricted to the IgG2 subclass.
The Journal of allergy and clinical immunology 123, 1268-76.e15 [PubMed:19443021]
[show Abstract]

Last Modified

19 February 2020

ChEBI

CHEBI:17719 - β-D-glucose 6-phosphate

Background

Objective

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