N-Acetyl-α-D-glucosamine

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Systematic / IUPAC Name: 2-Acetamido-2-deoxy-α-D-glucopyranose

ID: Reference1186

Other Names: N-[(2S,5S,3R,4R,6R)-2,4,5-Trihydroxy-6-(hydroxymethyl)-2H-3,4,5,6-tetrahydropyran-3-yl]acetamide;
α-D-Glucopyranose, 2-(acetylamino)-2-deoxy-;
2-Acetamido-2-deoxy-D-glucose

Formula: C8H15NO6

Class: Endogenous Metabolites

Spectral Data

N-Acetyl-α-D-glucosamine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 73
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/5/2014 8:40:49 AM
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Identificators

InChI InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5-,6-,7-,8+/m1/s1
InChI Key OVRNDRQMDRJTHS-PVFLNQBWSA-N
Canonical SMILES CC(=O)NC1C(C(C(OC1O)CO)O)O
CAS 7512176
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Other Names N-[(2S,5S,3R,4R,6R)-2,4,5-Trihydroxy-6-(hydroxymethyl)-2H-3,4,5,6-tetrahydropyran-3-yl]acetamide;
α-D-Glucopyranose, 2-(acetylamino)-2-deoxy-;
2-Acetamido-2-deoxy-D-glucose

In Other Databases

ChEBI CHEBI:44278
ChemSpider 875; 21232697; 21233902; 21233903; 21234076; 21238766; 21242820
PubChem 82313
ChemIDPlus 010036643
KEGG C20328