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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2007-05-23 09:52:25 UTC
Update Date2021-09-14 15:46:13 UTC
HMDB IDHMDB0006456
Secondary Accession Numbers
  • HMDB06456
Metabolite Identification
Common NameN-Acetyl-L-glutamyl 5-phosphate
DescriptionN-Acetyl-L-glutamyl 5-phosphate, also known as N-acetyl-5-glutamyl phosphoric acid, belongs to the class of organic compounds known as glutamic acid and derivatives. Glutamic acid and derivatives are compounds containing glutamic acid or a derivative thereof resulting from reaction of glutamic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. N-Acetyl-L-glutamyl 5-phosphate exists in all living species, ranging from bacteria to plants to humans. N-Acetyl-L-glutamyl 5-phosphate has been detected, but not quantified in, several different foods, such as pears (Pyrus communis), sacred lotus (Nelumbo nucifera), common grapes (Vitis vinifera), cumins (Cuminum cyminum), and yali pears (Pyrus × bretschneideri). This could make N-acetyl-L-glutamyl 5-phosphate a potential biomarker for the consumption of these foods. N-Acetyl-L-glutamyl 5-phosphate is a primary metabolite. Primary metabolites are metabolically or physiologically essential metabolites. They are directly involved in an organism’s growth, development or reproduction. Based on a literature review very few articles have been published on N-Acetyl-L-glutamyl 5-phosphate.
Structure
Data?1586448506
Synonyms
ValueSource
N-Acetyl-5-glutamyl phosphateChEBI
N-Acetyl-5-oxo-5-(phosphonooxy)-L-norvalineChEBI
N-Acetyl-L-glutamate 5-phosphateChEBI
N-Acetyl-5-glutamyl phosphoric acidGenerator
N-Acetyl-L-glutamic acid 5-phosphoric acidGenerator
N-Acetyl-L-glutamyl 5-phosphoric acidGenerator
(2S)-2-acetamido-5-oxo-5-(Phosphonooxy)pentanoateHMDB
(2S)-2-acetamido-5-oxo-5-(Phosphonooxy)pentanoic acidHMDB
N-Acetyl-gamma-L-glutamyl phosphateHMDB
N-Acetyl-gamma-glutamyl phosphateHMDB
N-Acetyl-γ-glutamyl phosphateHMDB
Chemical FormulaC7H12NO8P
Average Molecular Weight269.1458
Monoisotopic Molecular Weight269.030052877
IUPAC Name(2S)-2-acetamido-5-oxo-5-(phosphonooxy)pentanoic acid
Traditional Name(2S)-2-acetamido-5-oxo-5-(phosphonooxy)pentanoic acid
CAS Registry Number15383-57-0
SMILES
CC(=O)N[C@@H](CCC(=O)OP(O)(O)=O)C(O)=O
InChI Identifier
InChI=1S/C7H12NO8P/c1-4(9)8-5(7(11)12)2-3-6(10)16-17(13,14)15/h5H,2-3H2,1H3,(H,8,9)(H,11,12)(H2,13,14,15)/t5-/m0/s1
InChI KeyFCVIHFVSXHOPSW-YFKPBYRVSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as glutamic acid and derivatives. Glutamic acid and derivatives are compounds containing glutamic acid or a derivative thereof resulting from reaction of glutamic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
KingdomOrganic compounds
Super ClassOrganic acids and derivatives
ClassCarboxylic acids and derivatives
Sub ClassAmino acids, peptides, and analogues
Direct ParentGlutamic acid and derivatives
Alternative Parents
Substituents
  • Glutamic acid or derivatives
  • N-acyl-alpha-amino acid
  • N-acyl-alpha amino acid or derivatives
  • N-acyl-l-alpha-amino acid
  • Acyl monophosphate
  • Acyl phosphate
  • Dicarboxylic acid or derivatives
  • Organic phosphoric acid derivative
  • Fatty acid
  • Acetamide
  • Secondary carboxylic acid amide
  • Carboxylic acid salt
  • Carboxamide group
  • Carboxylic acid
  • Carbonyl group
  • Organic salt
  • Organooxygen compound
  • Organonitrogen compound
  • Organopnictogen compound
  • Organic oxygen compound
  • Organic nitrogen compound
  • Organic oxide
  • Hydrocarbon derivative
  • Aliphatic acyclic compound
Molecular FrameworkAliphatic acyclic compounds
External Descriptors
Ontology
Not AvailableNot Available
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility3.64 g/LALOGPS
logP-1.9ALOGPS
logP-1.8ChemAxon
logS-1.9ALOGPS
pKa (Strongest Acidic)1.23ChemAxon
pKa (Strongest Basic)-1.8ChemAxon
Physiological Charge-3ChemAxon
Hydrogen Acceptor Count7ChemAxon
Hydrogen Donor Count4ChemAxon
Polar Surface Area150.23 ŲChemAxon
Rotatable Bond Count7ChemAxon
Refractivity51.89 m³·mol⁻¹ChemAxon
Polarizability21.95 ųChemAxon
Number of Rings0ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DarkChem[M+H]+161.44931661259
DarkChem[M-H]-159.65831661259
DeepCCS[M+H]+150.77630932474
DeepCCS[M-H]-148.53330932474
DeepCCS[M-2H]-181.77330932474
DeepCCS[M+Na]+156.71830932474
AllCCS[M+H]+157.132859911
AllCCS[M+H-H2O]+153.932859911
AllCCS[M+NH4]+160.132859911
AllCCS[M+Na]+161.032859911
AllCCS[M-H]-151.332859911
AllCCS[M+Na-2H]-151.932859911
AllCCS[M+HCOO]-152.632859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
N-Acetyl-L-glutamyl 5-phosphateCC(=O)N[C@@H](CCC(=O)OP(O)(O)=O)C(O)=O3296.7Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphateCC(=O)N[C@@H](CCC(=O)OP(O)(O)=O)C(O)=O1760.5Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphateCC(=O)N[C@@H](CCC(=O)OP(O)(O)=O)C(O)=O2353.6Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
N-Acetyl-L-glutamyl 5-phosphate,1TMS,isomer #1CC(=O)N[C@@H](CCC(=O)OP(=O)(O)O)C(=O)O[Si](C)(C)C2106.7Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,1TMS,isomer #2CC(=O)N[C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C)C(=O)O2118.5Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,1TMS,isomer #3CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O)C(=O)O)[Si](C)(C)C2128.0Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TMS,isomer #1CC(=O)N[C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2148.0Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TMS,isomer #1CC(=O)N[C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2177.8Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TMS,isomer #1CC(=O)N[C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C3157.0Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TMS,isomer #2CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C2147.6Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TMS,isomer #2CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C2200.0Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TMS,isomer #2CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C3408.1Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TMS,isomer #3CC(=O)N[C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O2180.9Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TMS,isomer #3CC(=O)N[C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O2221.4Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TMS,isomer #3CC(=O)N[C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O3057.1Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TMS,isomer #4CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C2166.2Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TMS,isomer #4CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C2235.0Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TMS,isomer #4CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C3182.2Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TMS,isomer #1CC(=O)N[C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2195.4Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TMS,isomer #1CC(=O)N[C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2253.1Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TMS,isomer #1CC(=O)N[C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2724.3Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TMS,isomer #2CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2180.3Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TMS,isomer #2CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2234.2Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TMS,isomer #2CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2864.1Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TMS,isomer #3CC(=O)N([C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C2201.8Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TMS,isomer #3CC(=O)N([C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C2301.2Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TMS,isomer #3CC(=O)N([C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C2757.3Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphate,4TMS,isomer #1CC(=O)N([C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2211.4Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,4TMS,isomer #1CC(=O)N([C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2297.1Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,4TMS,isomer #1CC(=O)N([C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2563.5Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphate,1TBDMS,isomer #1CC(=O)N[C@@H](CCC(=O)OP(=O)(O)O)C(=O)O[Si](C)(C)C(C)(C)C2356.7Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,1TBDMS,isomer #2CC(=O)N[C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(=O)O2362.2Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,1TBDMS,isomer #3CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O)C(=O)O)[Si](C)(C)C(C)(C)C2387.0Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TBDMS,isomer #1CC(=O)N[C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2587.0Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TBDMS,isomer #1CC(=O)N[C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2577.8Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TBDMS,isomer #1CC(=O)N[C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C3277.6Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TBDMS,isomer #2CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2623.2Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TBDMS,isomer #2CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2604.5Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TBDMS,isomer #2CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3449.1Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TBDMS,isomer #3CC(=O)N[C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O2622.5Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TBDMS,isomer #3CC(=O)N[C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O2618.0Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TBDMS,isomer #3CC(=O)N[C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O3190.3Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TBDMS,isomer #4CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C2628.4Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TBDMS,isomer #4CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C2628.9Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,2TBDMS,isomer #4CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C3285.3Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TBDMS,isomer #1CC(=O)N[C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2836.4Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TBDMS,isomer #1CC(=O)N[C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2773.7Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TBDMS,isomer #1CC(=O)N[C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C3009.1Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TBDMS,isomer #2CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2835.3Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TBDMS,isomer #2CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2813.6Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TBDMS,isomer #2CC(=O)N([C@@H](CCC(=O)OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3096.7Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TBDMS,isomer #3CC(=O)N([C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C2864.9Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TBDMS,isomer #3CC(=O)N([C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C2827.1Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,3TBDMS,isomer #3CC(=O)N([C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C3032.1Standard polar33892256
N-Acetyl-L-glutamyl 5-phosphate,4TBDMS,isomer #1CC(=O)N([C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3043.0Semi standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,4TBDMS,isomer #1CC(=O)N([C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2967.2Standard non polar33892256
N-Acetyl-L-glutamyl 5-phosphate,4TBDMS,isomer #1CC(=O)N([C@@H](CCC(=O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2939.0Standard polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - N-Acetyl-L-glutamyl 5-phosphate GC-MS (Non-derivatized) - 70eV, Positivesplash10-0002-9010000000-b0a55da1a5a5b19cb1d42016-09-22Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - N-Acetyl-L-glutamyl 5-phosphate GC-MS (1 TMS) - 70eV, Positivesplash10-006t-9010000000-42bde2dc702d9b13da762017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - N-Acetyl-L-glutamyl 5-phosphate GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - N-Acetyl-L-glutamyl 5-phosphate 10V, Positive-QTOFsplash10-0fka-3690000000-1006721922db38442ba62015-09-15Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - N-Acetyl-L-glutamyl 5-phosphate 20V, Positive-QTOFsplash10-007k-4930000000-eb999b44d4988128c1c92015-09-15Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - N-Acetyl-L-glutamyl 5-phosphate 40V, Positive-QTOFsplash10-0002-9500000000-78a70933fe87b25941ad2015-09-15Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - N-Acetyl-L-glutamyl 5-phosphate 10V, Negative-QTOFsplash10-004i-9050000000-71b3eb12e2ae4f4194552015-09-15Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - N-Acetyl-L-glutamyl 5-phosphate 20V, Negative-QTOFsplash10-004i-9000000000-eb5a9659d9563f71cfed2015-09-15Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - N-Acetyl-L-glutamyl 5-phosphate 40V, Negative-QTOFsplash10-004i-9000000000-9428bc78f2587e624b2e2015-09-15Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - N-Acetyl-L-glutamyl 5-phosphate 10V, Negative-QTOFsplash10-004i-9010000000-fdf484605ec8efcf19732021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - N-Acetyl-L-glutamyl 5-phosphate 20V, Negative-QTOFsplash10-004i-9000000000-5c2f91e14126fc9d09522021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - N-Acetyl-L-glutamyl 5-phosphate 40V, Negative-QTOFsplash10-004i-9000000000-7084495cb0b628b5da4a2021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - N-Acetyl-L-glutamyl 5-phosphate 10V, Positive-QTOFsplash10-00b9-0090000000-041c62aaf9a011fbf28a2021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - N-Acetyl-L-glutamyl 5-phosphate 20V, Positive-QTOFsplash10-003r-2930000000-e4bd8858ef8860dc91112021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - N-Acetyl-L-glutamyl 5-phosphate 40V, Positive-QTOFsplash10-0035-9400000000-2015735feb749a5b240b2021-09-22Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-29Wishart LabView Spectrum
Biological Properties
Cellular Locations
  • Mitochondria
Biospecimen LocationsNot Available
Tissue LocationsNot Available
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB023917
KNApSAcK IDNot Available
Chemspider ID389220
KEGG Compound IDC04133
BioCyc IDN-ACETYL-GLUTAMYL-P
BiGG ID43209
Wikipedia LinkNot Available
METLIN ID3396
PubChem Compound440236
PDB IDX2W
ChEBI ID16878
Food Biomarker OntologyNot Available
VMH IDACG5P
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceKuramitsu, Shigenori; Masui, Ryoji. Cloning of thermostable acetylglutamate kinase gene from Sulfolobus tokodaii and use for N-acetyl-L-glutamate-5-phosphate biosynthesis. Jpn. Kokai Tokkyo Koho (2004), 12 pp. CODEN: JKXXAF JP 2004298187 A 20041028 CAN 141:362386 AN 2004:900796
Material Safety Data Sheet (MSDS)Not Available
General ReferencesNot Available