Details of the Drug Metabolized by Drug-Metabolizing Enzyme (DME)

General Information of Drug (ID: DR2080)
Drug Name
D-glucosamine-phosphate
Synonyms
D-glucosamine 6-phosphate; D-glucosamine phosphate; EN300-258467; XHMJOUIAFHJHBW-IVMDWMLBSA-N; glucosamine-6-phosphate; 2-Amino-2-deoxy-D-glucopyranose 6-phosphoric acid; D-GLUCOSAMINE6-PHOSPHATE; 2-amino-2-deoxy-6-O-phosphono-D-glucopyranose; 2-amino-2-deoxy-D-glucopyranose 6-(dihydrogen phosphate); 2-amino-2-deoxy-D-glucopyranose 6-phosphate; 6590AH; AC1L9AD1; C00352; C6H14NO8P; CHEBI:47987; CHEMBL3426569; MFCD00067382; SCHEMBL13321929; WURCS=2.0/1,1,0/[a2122h-1x_1-5_2*N_6*OPO/3O/3=O]/1/
Indication Discovery agent Investigative [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 259.149 Topological Polar Surface Area 163
Heavy Atom Count 16 Rotatable Bond Count 3
Hydrogen Bond Donor Count 6 Hydrogen Bond Acceptor Count 9
Cross-matching ID
PubChem CID
440997
ChEBI ID
CHEBI:47987
CAS Number
3616-42-0
Formula
C6H14NO8P
Canonical SMILES
C(C1C(C(C(C(O1)O)N)O)O)OP(=O)(O)O
InChI
1S/C6H14NO8P/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H2,11,12,13)/t2-,3-,4-,5-,6?/m1/s1
InChIKey
XHMJOUIAFHJHBW-IVMDWMLBSA-N
The Metabolic Roadmap of This Drug
The Full List of Drug Metabolites (DM) of This Drug
DM Name DM ID PubChem ID Reaction DM Level REF
Glucosamine 1-phosphate DM005862
188960
Unclear 1 [3]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR006270 D-glucosamine-phosphate Glucosamine 1-phosphate Unclear glmM [3]
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
Glucosamine-6-phosphate deaminase 1 (GNPDA1) DME0521 Homo sapiens
GNPI1_HUMAN
3.5.99.6
[2]
Glucosamine-6-phosphate deaminase 2 (GNPDA2) DME0522 Homo sapiens
GNPI2_HUMAN
3.5.99.6
[2]
phosphoglucosamine mutase (glmM) DMEN314 Escherichia coli
GLMM_ECOLI
5.4.2.10
[3]
Experimental Enzyme Kinetic Data of This Drug
DME Name DME Info Kinetic Data Uniprot ID REF
Glucosamine-6-phosphate deaminase 1 (GNPDA1) DME0521 Km = 0.27 microM
GNPI1_HUMAN
[2]
Glucosamine-6-phosphate deaminase 2 (GNPDA2) DME0522 Km = 0.27 microM
GNPI2_HUMAN
[2]
References
1 DrugBank 5.0: a major update to the DrugBank database for 2018. Nucleic Acids Res. 2018 Jan 4;46(D1):D1074-D1082. (id: DB03951)
2 Allosteric kinetics of the isoform 1 of human glucosamine-6-phosphate deaminase. Biochim Biophys Acta. 2011 Dec;1814(12):1846-53.
3 Allosteric Modulation of the Faecalibacterium prausnitzii Hepatitis Delta Virus-like Ribozyme by Glucosamine 6-Phosphate: The Substrate of the Adjacent Gene Product

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