Hmdb loader
Record Information
Version5.0
StatusDetected but not Quantified
Creation Date2009-02-03 12:24:18 UTC
Update Date2023-02-21 17:17:33 UTC
HMDB IDHMDB0011667
Secondary Accession Numbers
  • HMDB0029149
  • HMDB11667
  • HMDB29149
Metabolite Identification
Common Namegamma-Glutamylglycine
Descriptiongamma-Glutamylglycine is one of the dipeptides that is commonly produced from polypeptides by the action of the enzyme dipeptidyl peptidase. Dietary proteins are digested to dipeptides and amino acids, and the dipeptides are absorbed more rapidly than the amino acids because their uptake involves a separate mechanism. Dipeptides activate G-cells found in the stomach to secrete gastrin. gamma-Glutamylglycine is an excitatory amino acid receptor antagonist with a structure similar to gamma-aminobutyric acid (GABA) (PMID: 6146532 ).
Structure
Data?1676999853
Synonyms
ValueSource
5-L-GlutamylglycineChEBI
gamma-L-Glu-glyChEBI
L-gamma-Glu-glyChEBI
N-L-gamma-GlutamylglycineChEBI
g-L-Glu-glyGenerator
Γ-L-glu-glyGenerator
L-g-Glu-glyGenerator
L-Γ-glu-glyGenerator
N-L-g-GlutamylglycineGenerator
N-L-Γ-glutamylglycineGenerator
g-GlutamylglycineGenerator
Γ-glutamylglycineGenerator
γ-Glu-GlyHMDB, Generator
γ-L-GlutamylglycineHMDB
L-γ-GlutamylglycineHMDB
N-γ-GlutamylglycineHMDB
N-γ-L-GlutamylglycineHMDB
gamma-Glu-GlyHMDB
gamma-L-GlutamylglycineHMDB
L-gamma-GlutamylglycineHMDB
N-gamma-GlutamylglycineHMDB
N-gamma-L-GlutamylglycineHMDB
N-(Carboxymethyl)-glutamineHMDB
L-N-(Carboxymethyl)-glutamineHMDB
gamma-GlutamylglycineHMDB, MeSH
5-L-Glutamyl-glycineHMDB
gamma-Glutamyl glycineHMDB
gamma-L-Glutamyl-glycineHMDB
N-L-gamma-Glutamyl-glycineHMDB
g-Glu-GlyGenerator, HMDB
Chemical FormulaC7H12N2O5
Average Molecular Weight204.1806
Monoisotopic Molecular Weight204.074621504
IUPAC Name(2S)-2-amino-4-[(carboxymethyl)carbamoyl]butanoic acid
Traditional Name(2S)-2-amino-4-(carboxymethylcarbamoyl)butanoic acid
CAS Registry Number1948-29-4
SMILES
N[C@@H](CCC(=O)NCC(O)=O)C(O)=O
InChI Identifier
InChI=1S/C7H12N2O5/c8-4(7(13)14)1-2-5(10)9-3-6(11)12/h4H,1-3,8H2,(H,9,10)(H,11,12)(H,13,14)/t4-/m0/s1
InChI KeyACIJGUBIMXQCMF-BYPYZUCNSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
KingdomOrganic compounds
Super ClassOrganic acids and derivatives
ClassCarboxylic acids and derivatives
Sub ClassAmino acids, peptides, and analogues
Direct ParentDipeptides
Alternative Parents
Substituents
  • Alpha-dipeptide
  • Gamma-glutamyl alpha-amino acid
  • Glutamine or derivatives
  • N-acyl-alpha-amino acid
  • N-acyl-alpha amino acid or derivatives
  • Alpha-amino acid
  • Alpha-amino acid or derivatives
  • L-alpha-amino acid
  • N-acyl-amine
  • Fatty amide
  • Dicarboxylic acid or derivatives
  • Fatty acid
  • Fatty acyl
  • Carboxamide group
  • Secondary carboxylic acid amide
  • Amino acid
  • Amino acid or derivatives
  • Carboxylic acid
  • Organic nitrogen compound
  • Primary aliphatic amine
  • Organonitrogen compound
  • Organooxygen compound
  • Primary amine
  • Hydrocarbon derivative
  • Organic oxide
  • Carbonyl group
  • Organopnictogen compound
  • Amine
  • Organic oxygen compound
  • Aliphatic acyclic compound
Molecular FrameworkAliphatic acyclic compounds
External Descriptors
Ontology
Physiological effectNot Available
Disposition
ProcessNot Available
RoleNot 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 Solubility21.2 g/LALOGPS
logP-3.5ALOGPS
logP-4.4ChemAxon
logS-0.98ALOGPS
pKa (Strongest Acidic)1.83ChemAxon
pKa (Strongest Basic)9.31ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count6ChemAxon
Hydrogen Donor Count4ChemAxon
Polar Surface Area129.72 ŲChemAxon
Rotatable Bond Count6ChemAxon
Refractivity44.09 m³·mol⁻¹ChemAxon
Polarizability18.82 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]+147.74831661259
DarkChem[M-H]-142.65431661259
DeepCCS[M+H]+140.38830932474
DeepCCS[M-H]-138.02330932474
DeepCCS[M-2H]-173.4330932474
DeepCCS[M+Na]+148.75330932474
AllCCS[M+H]+143.532859911
AllCCS[M+H-H2O]+139.932859911
AllCCS[M+NH4]+146.832859911
AllCCS[M+Na]+147.732859911
AllCCS[M-H]-141.132859911
AllCCS[M+Na-2H]-142.032859911
AllCCS[M+HCOO]-143.132859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
gamma-GlutamylglycineN[C@@H](CCC(=O)NCC(O)=O)C(O)=O2866.2Standard polar33892256
gamma-GlutamylglycineN[C@@H](CCC(=O)NCC(O)=O)C(O)=O1665.9Standard non polar33892256
gamma-GlutamylglycineN[C@@H](CCC(=O)NCC(O)=O)C(O)=O2357.1Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
gamma-Glutamylglycine,1TMS,isomer #1C[Si](C)(C)OC(=O)CNC(=O)CC[C@H](N)C(=O)O2038.2Semi standard non polar33892256
gamma-Glutamylglycine,1TMS,isomer #2C[Si](C)(C)OC(=O)[C@@H](N)CCC(=O)NCC(=O)O1980.1Semi standard non polar33892256
gamma-Glutamylglycine,1TMS,isomer #3C[Si](C)(C)N[C@@H](CCC(=O)NCC(=O)O)C(=O)O2041.8Semi standard non polar33892256
gamma-Glutamylglycine,1TMS,isomer #4C[Si](C)(C)N(CC(=O)O)C(=O)CC[C@H](N)C(=O)O2051.2Semi standard non polar33892256
gamma-Glutamylglycine,2TMS,isomer #1C[Si](C)(C)OC(=O)CNC(=O)CC[C@H](N)C(=O)O[Si](C)(C)C2039.9Semi standard non polar33892256
gamma-Glutamylglycine,2TMS,isomer #2C[Si](C)(C)N[C@@H](CCC(=O)NCC(=O)O[Si](C)(C)C)C(=O)O2120.6Semi standard non polar33892256
gamma-Glutamylglycine,2TMS,isomer #3C[Si](C)(C)OC(=O)CN(C(=O)CC[C@H](N)C(=O)O)[Si](C)(C)C2080.2Semi standard non polar33892256
gamma-Glutamylglycine,2TMS,isomer #4C[Si](C)(C)N[C@@H](CCC(=O)NCC(=O)O)C(=O)O[Si](C)(C)C2086.8Semi standard non polar33892256
gamma-Glutamylglycine,2TMS,isomer #5C[Si](C)(C)OC(=O)[C@@H](N)CCC(=O)N(CC(=O)O)[Si](C)(C)C2031.6Semi standard non polar33892256
gamma-Glutamylglycine,2TMS,isomer #6C[Si](C)(C)N([C@@H](CCC(=O)NCC(=O)O)C(=O)O)[Si](C)(C)C2186.2Semi standard non polar33892256
gamma-Glutamylglycine,2TMS,isomer #7C[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O)[Si](C)(C)C)C(=O)O2126.7Semi standard non polar33892256
gamma-Glutamylglycine,3TMS,isomer #1C[Si](C)(C)N[C@@H](CCC(=O)NCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2130.7Semi standard non polar33892256
gamma-Glutamylglycine,3TMS,isomer #1C[Si](C)(C)N[C@@H](CCC(=O)NCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2131.1Standard non polar33892256
gamma-Glutamylglycine,3TMS,isomer #1C[Si](C)(C)N[C@@H](CCC(=O)NCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2604.9Standard polar33892256
gamma-Glutamylglycine,3TMS,isomer #2C[Si](C)(C)OC(=O)CN(C(=O)CC[C@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C2062.1Semi standard non polar33892256
gamma-Glutamylglycine,3TMS,isomer #2C[Si](C)(C)OC(=O)CN(C(=O)CC[C@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C2117.1Standard non polar33892256
gamma-Glutamylglycine,3TMS,isomer #2C[Si](C)(C)OC(=O)CN(C(=O)CC[C@H](N)C(=O)O[Si](C)(C)C)[Si](C)(C)C3000.2Standard polar33892256
gamma-Glutamylglycine,3TMS,isomer #3C[Si](C)(C)OC(=O)CNC(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C2260.5Semi standard non polar33892256
gamma-Glutamylglycine,3TMS,isomer #3C[Si](C)(C)OC(=O)CNC(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C2184.0Standard non polar33892256
gamma-Glutamylglycine,3TMS,isomer #3C[Si](C)(C)OC(=O)CNC(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C2750.6Standard polar33892256
gamma-Glutamylglycine,3TMS,isomer #4C[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O2130.5Semi standard non polar33892256
gamma-Glutamylglycine,3TMS,isomer #4C[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O2141.5Standard non polar33892256
gamma-Glutamylglycine,3TMS,isomer #4C[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O2727.6Standard polar33892256
gamma-Glutamylglycine,3TMS,isomer #5C[Si](C)(C)OC(=O)[C@H](CCC(=O)NCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C2241.6Semi standard non polar33892256
gamma-Glutamylglycine,3TMS,isomer #5C[Si](C)(C)OC(=O)[C@H](CCC(=O)NCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C2125.5Standard non polar33892256
gamma-Glutamylglycine,3TMS,isomer #5C[Si](C)(C)OC(=O)[C@H](CCC(=O)NCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C2764.7Standard polar33892256
gamma-Glutamylglycine,3TMS,isomer #6C[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O)[Si](C)(C)C)C(=O)O[Si](C)(C)C2109.7Semi standard non polar33892256
gamma-Glutamylglycine,3TMS,isomer #6C[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O)[Si](C)(C)C)C(=O)O[Si](C)(C)C2159.3Standard non polar33892256
gamma-Glutamylglycine,3TMS,isomer #6C[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O)[Si](C)(C)C)C(=O)O[Si](C)(C)C2615.1Standard polar33892256
gamma-Glutamylglycine,3TMS,isomer #7C[Si](C)(C)N(CC(=O)O)C(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C2215.3Semi standard non polar33892256
gamma-Glutamylglycine,3TMS,isomer #7C[Si](C)(C)N(CC(=O)O)C(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C2223.0Standard non polar33892256
gamma-Glutamylglycine,3TMS,isomer #7C[Si](C)(C)N(CC(=O)O)C(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C2777.4Standard polar33892256
gamma-Glutamylglycine,4TMS,isomer #1C[Si](C)(C)OC(=O)CNC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2266.3Semi standard non polar33892256
gamma-Glutamylglycine,4TMS,isomer #1C[Si](C)(C)OC(=O)CNC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2213.1Standard non polar33892256
gamma-Glutamylglycine,4TMS,isomer #1C[Si](C)(C)OC(=O)CNC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2428.7Standard polar33892256
gamma-Glutamylglycine,4TMS,isomer #2C[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C2115.4Semi standard non polar33892256
gamma-Glutamylglycine,4TMS,isomer #2C[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C2172.8Standard non polar33892256
gamma-Glutamylglycine,4TMS,isomer #2C[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C2341.8Standard polar33892256
gamma-Glutamylglycine,4TMS,isomer #3C[Si](C)(C)OC(=O)CN(C(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2237.7Semi standard non polar33892256
gamma-Glutamylglycine,4TMS,isomer #3C[Si](C)(C)OC(=O)CN(C(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2264.9Standard non polar33892256
gamma-Glutamylglycine,4TMS,isomer #3C[Si](C)(C)OC(=O)CN(C(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2510.7Standard polar33892256
gamma-Glutamylglycine,4TMS,isomer #4C[Si](C)(C)OC(=O)[C@H](CCC(=O)N(CC(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2250.0Semi standard non polar33892256
gamma-Glutamylglycine,4TMS,isomer #4C[Si](C)(C)OC(=O)[C@H](CCC(=O)N(CC(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2246.2Standard non polar33892256
gamma-Glutamylglycine,4TMS,isomer #4C[Si](C)(C)OC(=O)[C@H](CCC(=O)N(CC(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2467.0Standard polar33892256
gamma-Glutamylglycine,5TMS,isomer #1C[Si](C)(C)OC(=O)CN(C(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2278.1Semi standard non polar33892256
gamma-Glutamylglycine,5TMS,isomer #1C[Si](C)(C)OC(=O)CN(C(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2267.6Standard non polar33892256
gamma-Glutamylglycine,5TMS,isomer #1C[Si](C)(C)OC(=O)CN(C(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2259.4Standard polar33892256
gamma-Glutamylglycine,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CNC(=O)CC[C@H](N)C(=O)O2307.1Semi standard non polar33892256
gamma-Glutamylglycine,1TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)[C@@H](N)CCC(=O)NCC(=O)O2266.2Semi standard non polar33892256
gamma-Glutamylglycine,1TBDMS,isomer #3CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)NCC(=O)O)C(=O)O2316.2Semi standard non polar33892256
gamma-Glutamylglycine,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)N(CC(=O)O)C(=O)CC[C@H](N)C(=O)O2312.7Semi standard non polar33892256
gamma-Glutamylglycine,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CNC(=O)CC[C@H](N)C(=O)O[Si](C)(C)C(C)(C)C2511.5Semi standard non polar33892256
gamma-Glutamylglycine,2TBDMS,isomer #2CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)NCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O2625.9Semi standard non polar33892256
gamma-Glutamylglycine,2TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CN(C(=O)CC[C@H](N)C(=O)O)[Si](C)(C)C(C)(C)C2559.1Semi standard non polar33892256
gamma-Glutamylglycine,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)NCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C2568.5Semi standard non polar33892256
gamma-Glutamylglycine,2TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)[C@@H](N)CCC(=O)N(CC(=O)O)[Si](C)(C)C(C)(C)C2523.8Semi standard non polar33892256
gamma-Glutamylglycine,2TBDMS,isomer #6CC(C)(C)[Si](C)(C)N([C@@H](CCC(=O)NCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C2669.8Semi standard non polar33892256
gamma-Glutamylglycine,2TBDMS,isomer #7CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O)[Si](C)(C)C(C)(C)C)C(=O)O2594.2Semi standard non polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)NCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2788.8Semi standard non polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)NCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2692.7Standard non polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)NCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2820.7Standard polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)CN(C(=O)CC[C@H](N)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2711.7Semi standard non polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)CN(C(=O)CC[C@H](N)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2716.3Standard non polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)CN(C(=O)CC[C@H](N)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3066.3Standard polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CNC(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2937.6Semi standard non polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CNC(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2736.5Standard non polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CNC(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2880.7Standard polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O2827.2Semi standard non polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O2694.0Standard non polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O2903.9Standard polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)NCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2916.4Semi standard non polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)NCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2710.4Standard non polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)NCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2896.4Standard polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2779.0Semi standard non polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2689.2Standard non polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2842.4Standard polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)N(CC(=O)O)C(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2904.3Semi standard non polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)N(CC(=O)O)C(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2748.9Standard non polar33892256
gamma-Glutamylglycine,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)N(CC(=O)O)C(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2917.7Standard polar33892256
gamma-Glutamylglycine,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CNC(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3130.9Semi standard non polar33892256
gamma-Glutamylglycine,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CNC(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2929.1Standard non polar33892256
gamma-Glutamylglycine,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CNC(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2783.9Standard polar33892256
gamma-Glutamylglycine,4TBDMS,isomer #2CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2975.0Semi standard non polar33892256
gamma-Glutamylglycine,4TBDMS,isomer #2CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2884.0Standard non polar33892256
gamma-Glutamylglycine,4TBDMS,isomer #2CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)N(CC(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2784.1Standard polar33892256
gamma-Glutamylglycine,4TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CN(C(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3130.5Semi standard non polar33892256
gamma-Glutamylglycine,4TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CN(C(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2952.5Standard non polar33892256
gamma-Glutamylglycine,4TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CN(C(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2835.2Standard polar33892256
gamma-Glutamylglycine,4TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)N(CC(=O)O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3123.4Semi standard non polar33892256
gamma-Glutamylglycine,4TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)N(CC(=O)O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2937.6Standard non polar33892256
gamma-Glutamylglycine,4TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)N(CC(=O)O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2812.9Standard polar33892256
gamma-Glutamylglycine,5TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CN(C(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3323.0Semi standard non polar33892256
gamma-Glutamylglycine,5TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CN(C(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3111.6Standard non polar33892256
gamma-Glutamylglycine,5TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CN(C(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2783.4Standard polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - gamma-Glutamylglycine GC-MS (Non-derivatized) - 70eV, Positivesplash10-0536-9600000000-f3713ba3276d2d960d272017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - gamma-Glutamylglycine GC-MS (2 TMS) - 70eV, Positivesplash10-0089-7491000000-4cf0c60c40ac1ebb4a762017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - gamma-Glutamylglycine GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - gamma-Glutamylglycine 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 - gamma-Glutamylglycine 10V, Positive-QTOFsplash10-0a4i-1920000000-4f37f0492e666f37c8922017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - gamma-Glutamylglycine 20V, Positive-QTOFsplash10-0a6r-7900000000-7afc277125515fcc22322017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - gamma-Glutamylglycine 40V, Positive-QTOFsplash10-0a4i-9100000000-298d0d22ca619d4701c02017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - gamma-Glutamylglycine 10V, Negative-QTOFsplash10-0udi-0790000000-d8cc1593c46460175daa2017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - gamma-Glutamylglycine 20V, Negative-QTOFsplash10-0zg0-1930000000-7a4e5669b96e70411b482017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - gamma-Glutamylglycine 40V, Negative-QTOFsplash10-00di-9200000000-71292eef73981043b6652017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - gamma-Glutamylglycine 10V, Negative-QTOFsplash10-000i-2900000000-850fda337bef74e3fc912021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - gamma-Glutamylglycine 20V, Negative-QTOFsplash10-0fki-7910000000-04a3e783689357c0f7d52021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - gamma-Glutamylglycine 40V, Negative-QTOFsplash10-00di-9000000000-38fe5d70392f90ae21bb2021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - gamma-Glutamylglycine 10V, Positive-QTOFsplash10-0a5i-2970000000-90491b3f0955e2d88a752021-09-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - gamma-Glutamylglycine 20V, Positive-QTOFsplash10-001i-9400000000-efb1bd9a2f2c091cad622021-09-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - gamma-Glutamylglycine 40V, Positive-QTOFsplash10-0ac0-9000000000-6025fc2c42c63c0571292021-09-25Wishart 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

IR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted IR SpectrumIR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M-H]-)2023-02-03FELIX labView Spectrum
Predicted IR SpectrumIR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M+H]+)2023-02-03FELIX labView Spectrum
Predicted IR SpectrumIR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M+Na]+)2023-02-03FELIX labView Spectrum
Biological Properties
Cellular LocationsNot Available
Biospecimen Locations
  • Blood
  • Feces
  • Urine
Tissue LocationsNot Available
Pathways
Normal Concentrations
BiospecimenStatusValueAgeSexConditionReferenceDetails
FecesDetected but not QuantifiedNot QuantifiedAdult (>18 years old)Both
Normal
details
FecesDetected but not QuantifiedNot QuantifiedAdult (>18 years old)Both
Normal
details
Abnormal Concentrations
BiospecimenStatusValueAgeSexConditionReferenceDetails
BloodExpected but not QuantifiedNot QuantifiedNot SpecifiedNot SpecifiedCancer patients undergoing total body irradiation details
UrineDetected but not QuantifiedNot QuantifiedNot SpecifiedNot SpecifiedCancer patients undergoing total body irradiation details
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB028356
KNApSAcK IDNot Available
Chemspider ID145071
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound165527
PDB IDNot Available
ChEBI ID73845
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Download (PDF)
General References
  1. Sawada S, Yamamoto C: Gamma-D-glutamylglycine and cis-2,3-piperidine dicarboxylate as antagonists of excitatory amino acids in the hippocampus. Exp Brain Res. 1984;55(2):351-8. [PubMed:6146532 ]