General Information of MET (ID: META00783)
Name Aspartylglycosamine
Synonyms   Click to Show/Hide Synonyms of This Metabolite
(N-g-(2-Acetamido-2-deoxy-b-D-gluco-pyranosyl)-L-asparagine; (N-gamma-(2-Acetamido-2-deoxy-beta-D-gluco-pyranosyl)-L-asparagine; (N-gamma-(2-Acetamido-2-deoxy-beta-delta-gluco-pyranosyl)-L-asparagine; 1-beta-Aspartyl-N-acetyl-D-glucosaminylamine; 2-Acetamido-1-(beta-L-aspartamido)-1,2-dideoxy-beta-D-glucose', 2-Acetamido-1-N-(4'-L-aspartyl)-2-deoxy-beta-D-glucopyranosylamine, '2-Acetamido-N-L-beta-aspartyl-2-deoxy-beta-D-glucopyranosylamine; 2-Acetamido-1-b-(L-aspartamido)-1,2-dideoxy-D-glucose; 2-Acetamido-1-beta-(L-aspartamido)-1,2-dideoxy-D-glucose; 2-Acetamido-1-beta-(L-aspartamido)-1,2-dideoxy-delta-glucose', 2-Acetamido-1-N-(4'-L-aspartyl)-2-deoxy-beta-delta-glucopyranosylamine, '4-N-2-Acetamido-2-deoxy-beta-D-glucopyranosyl-L-asparagine; 2-Acetamido-N(1)-L-beta-aspartyl-2-deoxy-beta-D-glucopyranosylamine; 4-N-2-Acetamido-2-deoxy-beta-delta-glucopyranosyl-L-asparagine; AADG; Acetylglucosaminylasparagine; Asparaginylglucosamine; Aspartylglucosamine; Aspartylglucosylamine; Aspartylglycosamine; H-Asn(glcnac-b-D)-OH; H-Asn(glcnac-beta-D)-OH; N(4)-(2-Acetamido-2-deoxy-beta-D-glucopyranosyl)-L-asparagine; N(4)-(2-Acetamido-2-deoxyglucopyranosyl)asparagine; N(4)-(Acetyl-beta-D-glucosaminyl)asparagine; N(4)-(beta-N-Acetyl-D-glucosaminyl)-L-asparagine; N-(2-(Acetylamino)-2-deoxy-beta-D-glucopyranosyl)L-asparagine; N-(2-(Acetylamino)-2-deoxy-beta-delta-glucopyranosyl)L-asparagine; N-(2-Acetylamino)-2-deoxy-beta-D-glucopyranosyl-L-asparagine; N-(2-Acetylamino)-2-deoxy-beta-delta-glucopyranosyl-L-asparagine; N-ADGP-asn; N-Acetylglucosaminylasparagine; N4-(Acetyl-beta-D-glucosaminyl)asparagine; N4-(beta-N-Acetyl-D-glucosaminyl)-L-asparagine; b-D-GlcNAc-1->n-asn; beta-D-GlcNAc-1->n-asn; beta-N-Acetylglucosaminyl-L-asparagine; beta-delta-GlcNAc-1->n-asn
Source Endogenous;Food
Structure Type   Carbohydrates and carbohydrate conjugates  (Click to Show/Hide the Complete Structure Type Hierarchy)
Organic oxygen compounds
Organooxygen compounds
Carbohydrates and carbohydrate conjugates
PubChem CID
123826
HMDB ID
HMDB0000489
Formula
C12H21N3O8
Structure
<iframe style="width: 300px; height: 300px;" frameborder="0" src="https://embed.molview.org/v1/?mode=balls&cid=123826"></iframe>
3D MOL 2D MOL
  Click to Show/Hide the Molecular/Functional Data (External Links/Property/Function) of This Metabolite
KEGG ID
C04540
ChEBI ID
17261
FooDB ID
FDB022071
ChemSpider ID
110370
METLIN ID
5476
Physicochemical Properties Molecular Weight 335.31 Topological Polar Surface Area 191
XlogP -5.7 Complexity 460
Heavy Atom Count 23 Rotatable Bond Count 6
Hydrogen Bond Donor Count 7 Hydrogen Bond Acceptor Count 9
Function
Aspartylglycosamine, also known as n4-(beta-N-acetyl-D-glucosaminyl)-L-asparagine or 1-beta-aspartyl-N-acetyl-D-glucosaminylamine, is a member of the class of compounds known as glycosylamines. Glycosylamines are compounds consisting of an amine with a beta-N-glycosidic bond to a carbohydrate, thus forming a cyclic hemiaminal ether bond (alpha-amino ether). Aspartylglycosamine is soluble (in water) and a moderately acidic compound (based on its pKa). Aspartylglycosamine can be found primarily in urine, as well as in human spleen tissue. Within the cell, aspartylglycosamine is primarily located in the cytoplasm. Moreover, aspartylglycosamine is found to be associated with aspartylglucosaminuria, which is an inborn error of metabolism. Large amount of aspartylglycosamine appears in patients with aspartylglycosaminuria corresponding to decreased activity of aspartylglycosamine amido hydrolase.
Regulatory Network
Full List of Protein(s) Regulating This Metabolite
      Vitamin D receptor (VDR)
            Vitamin D3 receptor (VDR) Click to Show/Hide the Full List of Regulating Pair(s):   1 Pair(s)
               Detailed Information Protein   Info click to show the details of this protein
               Regulating Pair Experim Info click to show the details of experiment for validating this pair [1]
                      Introduced Variation Knockout of VDR
                      Induced Change Aspartylglycosamine concentration: decrease
                      Summary Introduced Variation         Induced Change 
                      Disease Status Healthy individual
                      Details It is reported that knockout of VDR leads to the decrease of aspartylglycosamine levels compared with control group.
References
1 Vitamin D receptor promotes healthy microbial metabolites and microbiome. Sci Rep. 2020 Apr 30;10(1):7340.

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