Hmdb loader
Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-06 21:02:37 UTC
Update Date2021-09-14 15:36:53 UTC
HMDB IDHMDB0028818
Secondary Accession Numbers
  • HMDB28818
Metabolite Identification
Common NameGlutamylglutamic acid
DescriptionGlutamylglutamic acid is a dipeptide composed of two glutamic acid residues, and is a proteolytic breakdown product of larger proteins. It belongs to the family of N-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom. Glutamylglutamic acid is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
Structure
Data?1582753344
Synonyms
ValueSource
H-Glu-glu-OHChEBI
H-L-Glu-L-glu-OHChEBI
L-Glu-L-gluChEBI
L-alpha-Glutamyl-L-glutamic acidKegg
Glu-gluKegg
L-a-Glutamyl-L-glutamateGenerator
L-a-Glutamyl-L-glutamic acidGenerator
L-alpha-Glutamyl-L-glutamateGenerator
L-Α-glutamyl-L-glutamateGenerator
L-Α-glutamyl-L-glutamic acidGenerator
GlutamylglutamateGenerator
E-EHMDB
EEHMDB
Glutamyl-glutamateHMDB
Dipotassium glutamyl-glutamateHMDB
Α-glu-gluHMDB
Α-L-glu-L-gluHMDB
Α-glutamylglutamic acidHMDB
Α-glutamylglutamateHMDB
Α-L-glutamyl-L-glutamic acidHMDB
Α-L-glutamyl-L-glutamateHMDB
N-Α-glutamylglutamic acidHMDB
N-Α-glutamylglutamateHMDB
N-Α-L-glutamyl-L-glutamic acidHMDB
N-Α-L-glutamyl-L-glutamateHMDB
N-L-Α-glutamylglutamic acidHMDB
N-L-Α-glutamylglutamateHMDB
N-L-Α-glutamyl-L-glutamic acidHMDB
N-L-Α-glutamyl-L-glutamateHMDB
alpha-Glu-gluHMDB
alpha-L-Glu-L-gluHMDB
alpha-Glutamylglutamic acidHMDB
alpha-GlutamylglutamateHMDB
alpha-L-Glutamyl-L-glutamic acidHMDB
alpha-L-Glutamyl-L-glutamateHMDB
N-alpha-Glutamylglutamic acidHMDB
N-alpha-GlutamylglutamateHMDB
N-alpha-L-Glutamyl-L-glutamic acidHMDB
N-alpha-L-Glutamyl-L-glutamateHMDB
N-L-alpha-Glutamylglutamic acidHMDB
N-L-alpha-GlutamylglutamateHMDB
N-L-alpha-Glutamyl-L-glutamic acidHMDB
N-L-alpha-Glutamyl-L-glutamateHMDB
NSC 335983HMDB
L-Glutamyl-L-glutamic acidHMDB
L-Glutamyl-L-glutamateHMDB
N-Glutamylglutamic acidHMDB
N-GlutamylglutamateHMDB
N-L-Glutamyl-L-glutamic acidHMDB
N-L-Glutamyl-L-glutamateHMDB
Glutamyl-glutamic acidHMDB
Glutamic acid glutamic acid dipeptideHMDB
Glutamic acid glutamate dipeptideHMDB
Glutamate glutamic acid dipeptideHMDB
Glutamate glutamate dipeptideHMDB
Glutamic acid-glutamic acid dipeptideHMDB
Glutamic acid-glutamate dipeptideHMDB
Glutamate-glutamic acid dipeptideHMDB
Glutamate-glutamate dipeptideHMDB
e-e DipeptideHMDB
EE dipeptideHMDB
Glutamylglutamic acidHMDB
Chemical FormulaC10H16N2O7
Average Molecular Weight276.245
Monoisotopic Molecular Weight276.095750863
IUPAC Name(2S)-2-[(2S)-2-amino-4-carboxybutanamido]pentanedioic acid
Traditional NameGlu-Glu
CAS Registry Number3929-61-1
SMILES
N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O
InChI Identifier
InChI=1S/C10H16N2O7/c11-5(1-3-7(13)14)9(17)12-6(10(18)19)2-4-8(15)16/h5-6H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/t5-,6-/m0/s1
InChI KeyKOSRFJWDECSPRO-WDSKDSINSA-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
  • Glutamic acid or derivatives
  • N-acyl-alpha-amino acid
  • N-acyl-alpha amino acid or derivatives
  • N-acyl-l-alpha-amino acid
  • Alpha-amino acid amide
  • Alpha-amino acid or derivatives
  • Tricarboxylic acid or derivatives
  • Amino fatty acid
  • Fatty acyl
  • Fatty amide
  • N-acyl-amine
  • Amino acid
  • Secondary carboxylic acid amide
  • Amino acid or derivatives
  • Carboxamide group
  • Carboxylic acid
  • Organic nitrogen compound
  • Organonitrogen compound
  • Primary aliphatic amine
  • Organooxygen compound
  • Primary amine
  • Hydrocarbon derivative
  • Carbonyl group
  • Organic oxide
  • 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
LogP-4.37Extrapolated
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility68.7 g/LALOGPS
logP-3.2ALOGPS
logP-4.4ChemAxon
logS-1.5ALOGPS
pKa (Strongest Acidic)3.06ChemAxon
pKa (Strongest Basic)8.45ChemAxon
Physiological Charge-2ChemAxon
Hydrogen Acceptor Count8ChemAxon
Hydrogen Donor Count5ChemAxon
Polar Surface Area167.02 ŲChemAxon
Rotatable Bond Count9ChemAxon
Refractivity59.38 m³·mol⁻¹ChemAxon
Polarizability25.56 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
DeepCCS[M+H]+162.91630932474
DeepCCS[M-H]-160.55830932474
DeepCCS[M-2H]-193.44430932474
DeepCCS[M+Na]+169.00930932474
AllCCS[M+H]+159.132859911
AllCCS[M+H-H2O]+156.232859911
AllCCS[M+NH4]+161.932859911
AllCCS[M+Na]+162.732859911
AllCCS[M-H]-159.532859911
AllCCS[M+Na-2H]-159.832859911
AllCCS[M+HCOO]-160.232859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
Glutamylglutamic acidN[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O3686.9Standard polar33892256
Glutamylglutamic acidN[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O2006.0Standard non polar33892256
Glutamylglutamic acidN[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O2638.3Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
Glutamylglutamic acid,1TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)O2438.1Semi standard non polar33892256
Glutamylglutamic acid,1TMS,isomer #2C[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)O2452.2Semi standard non polar33892256
Glutamylglutamic acid,1TMS,isomer #3C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O2420.3Semi standard non polar33892256
Glutamylglutamic acid,1TMS,isomer #4C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O2486.0Semi standard non polar33892256
Glutamylglutamic acid,1TMS,isomer #5C[Si](C)(C)N(C(=O)[C@@H](N)CCC(=O)O)[C@@H](CCC(=O)O)C(=O)O2456.3Semi standard non polar33892256
Glutamylglutamic acid,2TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O2456.3Semi standard non polar33892256
Glutamylglutamic acid,2TMS,isomer #10C[Si](C)(C)N([C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C2648.9Semi standard non polar33892256
Glutamylglutamic acid,2TMS,isomer #11C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C2506.0Semi standard non polar33892256
Glutamylglutamic acid,2TMS,isomer #2C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C2436.0Semi standard non polar33892256
Glutamylglutamic acid,2TMS,isomer #3C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O2496.3Semi standard non polar33892256
Glutamylglutamic acid,2TMS,isomer #4C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C2429.0Semi standard non polar33892256
Glutamylglutamic acid,2TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)O[Si](C)(C)C2439.9Semi standard non polar33892256
Glutamylglutamic acid,2TMS,isomer #6C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O2502.3Semi standard non polar33892256
Glutamylglutamic acid,2TMS,isomer #7C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C2435.9Semi standard non polar33892256
Glutamylglutamic acid,2TMS,isomer #8C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C2492.2Semi standard non polar33892256
Glutamylglutamic acid,2TMS,isomer #9C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C2449.6Semi standard non polar33892256
Glutamylglutamic acid,3TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2461.4Semi standard non polar33892256
Glutamylglutamic acid,3TMS,isomer #10C[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O2635.2Semi standard non polar33892256
Glutamylglutamic acid,3TMS,isomer #11C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C2492.9Semi standard non polar33892256
Glutamylglutamic acid,3TMS,isomer #12C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C2624.2Semi standard non polar33892256
Glutamylglutamic acid,3TMS,isomer #13C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C2498.5Semi standard non polar33892256
Glutamylglutamic acid,3TMS,isomer #14C[Si](C)(C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[C@@H](CCC(=O)O)C(=O)O2634.6Semi standard non polar33892256
Glutamylglutamic acid,3TMS,isomer #2C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O2510.2Semi standard non polar33892256
Glutamylglutamic acid,3TMS,isomer #3C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C2433.6Semi standard non polar33892256
Glutamylglutamic acid,3TMS,isomer #4C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C2510.2Semi standard non polar33892256
Glutamylglutamic acid,3TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C2445.3Semi standard non polar33892256
Glutamylglutamic acid,3TMS,isomer #6C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C2629.6Semi standard non polar33892256
Glutamylglutamic acid,3TMS,isomer #7C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C2484.6Semi standard non polar33892256
Glutamylglutamic acid,3TMS,isomer #8C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2509.7Semi standard non polar33892256
Glutamylglutamic acid,3TMS,isomer #9C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C2442.5Semi standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #1C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2518.9Semi standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #1C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2504.8Standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #10C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2633.4Semi standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #10C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2629.4Standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #11C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2659.0Semi standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #11C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2596.1Standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #2C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2430.2Semi standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #2C[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2446.2Standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #3C[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O2651.2Semi standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #3C[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O2600.2Standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #4C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C2483.2Semi standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #4C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C2543.8Standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2655.1Semi standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2577.1Standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #6C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C2501.3Semi standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #6C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C2517.4Standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #7C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2635.5Semi standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #7C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2627.5Standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #8C[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C2651.5Semi standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #8C[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C2573.9Standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #9C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2495.9Semi standard non polar33892256
Glutamylglutamic acid,4TMS,isomer #9C[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2519.5Standard non polar33892256
Glutamylglutamic acid,5TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C2593.4Semi standard non polar33892256
Glutamylglutamic acid,5TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C2606.5Standard non polar33892256
Glutamylglutamic acid,5TMS,isomer #2C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2472.6Semi standard non polar33892256
Glutamylglutamic acid,5TMS,isomer #2C[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2552.9Standard non polar33892256
Glutamylglutamic acid,5TMS,isomer #3C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2636.0Semi standard non polar33892256
Glutamylglutamic acid,5TMS,isomer #3C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2643.7Standard non polar33892256
Glutamylglutamic acid,5TMS,isomer #4C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2661.0Semi standard non polar33892256
Glutamylglutamic acid,5TMS,isomer #4C[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2619.9Standard non polar33892256
Glutamylglutamic acid,5TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2648.6Semi standard non polar33892256
Glutamylglutamic acid,5TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2620.2Standard non polar33892256
Glutamylglutamic acid,6TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2663.3Semi standard non polar33892256
Glutamylglutamic acid,6TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CCC(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2655.7Standard non polar33892256
Glutamylglutamic acid,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)O2703.8Semi standard non polar33892256
Glutamylglutamic acid,1TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)O2720.6Semi standard non polar33892256
Glutamylglutamic acid,1TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O2701.4Semi standard non polar33892256
Glutamylglutamic acid,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O2740.7Semi standard non polar33892256
Glutamylglutamic acid,1TBDMS,isomer #5CC(C)(C)[Si](C)(C)N(C(=O)[C@@H](N)CCC(=O)O)[C@@H](CCC(=O)O)C(=O)O2699.0Semi standard non polar33892256
Glutamylglutamic acid,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O2923.3Semi standard non polar33892256
Glutamylglutamic acid,2TBDMS,isomer #10CC(C)(C)[Si](C)(C)N([C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C3084.9Semi standard non polar33892256
Glutamylglutamic acid,2TBDMS,isomer #11CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C2962.5Semi standard non polar33892256
Glutamylglutamic acid,2TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C2901.9Semi standard non polar33892256
Glutamylglutamic acid,2TBDMS,isomer #3CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O2958.0Semi standard non polar33892256
Glutamylglutamic acid,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C2900.9Semi standard non polar33892256
Glutamylglutamic acid,2TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C2896.7Semi standard non polar33892256
Glutamylglutamic acid,2TBDMS,isomer #6CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O2965.8Semi standard non polar33892256
Glutamylglutamic acid,2TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C(C)(C)C2906.8Semi standard non polar33892256
Glutamylglutamic acid,2TBDMS,isomer #8CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C2950.8Semi standard non polar33892256
Glutamylglutamic acid,2TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C(C)(C)C2902.6Semi standard non polar33892256
Glutamylglutamic acid,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C3130.3Semi standard non polar33892256
Glutamylglutamic acid,3TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O3307.7Semi standard non polar33892256
Glutamylglutamic acid,3TBDMS,isomer #11CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C3187.2Semi standard non polar33892256
Glutamylglutamic acid,3TBDMS,isomer #12CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3278.4Semi standard non polar33892256
Glutamylglutamic acid,3TBDMS,isomer #13CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3167.0Semi standard non polar33892256
Glutamylglutamic acid,3TBDMS,isomer #14CC(C)(C)[Si](C)(C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](CCC(=O)O)C(=O)O3273.9Semi standard non polar33892256
Glutamylglutamic acid,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O3173.7Semi standard non polar33892256
Glutamylglutamic acid,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C3137.0Semi standard non polar33892256
Glutamylglutamic acid,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C3158.8Semi standard non polar33892256
Glutamylglutamic acid,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3112.5Semi standard non polar33892256
Glutamylglutamic acid,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3313.9Semi standard non polar33892256
Glutamylglutamic acid,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C3178.1Semi standard non polar33892256
Glutamylglutamic acid,3TBDMS,isomer #8CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C3156.1Semi standard non polar33892256
Glutamylglutamic acid,3TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CCC(=O)O)[Si](C)(C)C(C)(C)C3112.9Semi standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C3355.9Semi standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C3170.1Standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3522.1Semi standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3234.3Standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3499.0Semi standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3213.9Standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCC(=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)C3320.9Semi standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](N)C(=O)N([C@@H](CCC(=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)C3143.9Standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O3552.9Semi standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O3244.9Standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #4CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C3383.9Semi standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #4CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C3185.8Standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3531.6Semi standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3211.4Standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #6CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3372.4Semi standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #6CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3163.5Standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3525.8Semi standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3234.1Standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C3520.6Semi standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C3211.1Standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #9CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCC(=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)C3371.8Semi standard non polar33892256
Glutamylglutamic acid,4TBDMS,isomer #9CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O)C(=O)N([C@@H](CCC(=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)C3163.9Standard non polar33892256
Glutamylglutamic acid,5TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C3743.3Semi standard non polar33892256
Glutamylglutamic acid,5TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C3384.4Standard non polar33892256
Glutamylglutamic acid,5TBDMS,isomer #2CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCC(=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)C3544.6Semi standard non polar33892256
Glutamylglutamic acid,5TBDMS,isomer #2CC(C)(C)[Si](C)(C)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCC(=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)C3335.1Standard non polar33892256
Glutamylglutamic acid,5TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=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)C3747.5Semi standard non polar33892256
Glutamylglutamic acid,5TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@H](CCC(=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)C3413.7Standard non polar33892256
Glutamylglutamic acid,5TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3737.9Semi standard non polar33892256
Glutamylglutamic acid,5TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3398.2Standard non polar33892256
Glutamylglutamic acid,5TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3734.4Semi standard non polar33892256
Glutamylglutamic acid,5TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3398.4Standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Glutamylglutamic acid GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Glutamylglutamic acid GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Glutamylglutamic acid GC-MS (TMS_3_14) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Glutamylglutamic acid GC-MS ("Glutamylglutamic acid,3TMS,#14" TMS) - 70eV, PositiveNot Available2021-10-14Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Glutamylglutamic acid 10V, Positive-QTOFsplash10-0a4l-0290000000-76b789646173b61ed4fa2019-02-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Glutamylglutamic acid 20V, Positive-QTOFsplash10-0f8i-4970000000-9cbad1bd6a593035540e2019-02-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Glutamylglutamic acid 40V, Positive-QTOFsplash10-0pb9-9300000000-c460156bc684004a59502019-02-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Glutamylglutamic acid 10V, Negative-QTOFsplash10-056r-0190000000-9e3e25b27b6eaae658302019-02-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Glutamylglutamic acid 20V, Negative-QTOFsplash10-06wa-0690000000-09030e2b5ebbd40e22682019-02-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Glutamylglutamic acid 40V, Negative-QTOFsplash10-0fba-4910000000-db01f4f48d03bf0d4e222019-02-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Glutamylglutamic acid 10V, Positive-QTOFsplash10-0f8a-0920000000-4dbb3cdf72ae961079ed2021-10-11Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Glutamylglutamic acid 20V, Positive-QTOFsplash10-0ue9-3900000000-773fed8aba0fea7bc9cc2021-10-11Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Glutamylglutamic acid 40V, Positive-QTOFsplash10-0pbi-9400000000-624328f5413180d57a672021-10-11Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Glutamylglutamic acid 10V, Negative-QTOFsplash10-056r-0290000000-6690f6055df71580c04e2021-10-11Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Glutamylglutamic acid 20V, Negative-QTOFsplash10-0fba-0910000000-d126ee750486e2c9abba2021-10-11Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Glutamylglutamic acid 40V, Negative-QTOFsplash10-0udi-4900000000-4210137e804fe4f7a7a82021-10-11Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Biological Properties
Cellular LocationsNot Available
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 IDFDB111863
KNApSAcK IDNot Available
Chemspider ID388598
KEGG Compound IDC01425
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound439500
PDB IDNot Available
ChEBI ID5390
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Sandberg M, Li X, Folestad S, Weber SG, Orwar O: Liquid chromatographic determination of acidic beta-aspartyl and gamma-glutamyl peptides in extracts of rat brain. Anal Biochem. 1994 Feb 15;217(1):48-61. [PubMed:7911284 ]
  2. Tamemoto H, Ishikawa SE, Kawakami M: Association of the Glu298Asp polymorphism of the eNOS Gene with ischemic heart disease in Japanese diabetic subjects. Diabetes Res Clin Pract. 2008 May;80(2):275-9. doi: 10.1016/j.diabres.2007.12.019. Epub 2008 Feb 19. [PubMed:18243394 ]
  3. Takahashi N, Sato T, Yamada T: Metabolic pathways for cytotoxic end product formation from glutamate- and aspartate-containing peptides by Porphyromonas gingivalis. J Bacteriol. 2000 Sep;182(17):4704-10. [PubMed:10940008 ]
  4. Takahashi N, Sato T: Preferential utilization of dipeptides by Porphyromonas gingivalis. J Dent Res. 2001 May;80(5):1425-9. [PubMed:11437213 ]
  5. Takahashi N, Sato T: Dipeptide utilization by the periodontal pathogens Porphyromonas gingivalis, Prevotella intermedia, Prevotella nigrescens and Fusobacterium nucleatum. Oral Microbiol Immunol. 2002 Feb;17(1):50-4. [PubMed:11860556 ]
  6. Varga V, Janaky R, Saransaari P, Oja SS: Endogenous gamma-L-glutamyl and beta-L-aspartyl peptides and excitatory aminoacidergic neurotransmission in the brain. Neuropeptides. 1994 Jul;27(1):19-26. [PubMed:7969817 ]
  7. Li X, Orwar O, Revesjo C, Sandberg M: Gamma-glutamyl peptides and related amino acids in rat hippocampus in vitro: effect of depolarization and gamma-glutamyl transpeptidase inhibition. Neurochem Int. 1996 Aug;29(2):121-8. [PubMed:8837040 ]
  8. Orwar O, Li X, Andine P, Bergstrom CM, Hagberg H, Folestad S, Sandberg M: Increased intra- and extracellular concentrations of gamma-glutamylglutamate and related dipeptides in the ischemic rat striatum: involvement of glutamyl transpeptidase. J Neurochem. 1994 Oct;63(4):1371-6. [PubMed:7931288 ]
  9. Neelakantan S, Surjawan I, Karacelik H, Hicks CL, Crooks PA: Synthesis of novel isoluminol probes and their use in rapid bacterial assays. Bioorg Med Chem Lett. 2009 Oct 1;19(19):5722-6. doi: 10.1016/j.bmcl.2009.08.004. Epub 2009 Aug 6. [PubMed:19700327 ]
  10. Kannan R, Kuhlenkamp JF, Ookhtens M, Kaplowitz N: Transport of glutathione at blood-brain barrier of the rat: inhibition by glutathione analogs and age-dependence. J Pharmacol Exp Ther. 1992 Dec;263(3):964-70. [PubMed:1469653 ]
  11. Hagen TM, Jones DP: Transepithelial transport of glutathione in vascularly perfused small intestine of rat. Am J Physiol. 1987 May;252(5 Pt 1):G607-13. [PubMed:3578519 ]
  12. McKernan TB, Woods EB, Lash LH: Uptake of glutathione by renal cortical mitochondria. Arch Biochem Biophys. 1991 Aug 1;288(2):653-63. [PubMed:1680311 ]
  13. Varga V, Janaky R, Holopainen I, Oja SS, Akerman KE: Endogenous gamma-L-glutamylglutamate is a partial agonist at the N-methyl-D-aspartate receptors in cultured cerebellar granule cells. Neurochem Res. 1995 Dec;20(12):1471-6. [PubMed:8789610 ]
  14. Tsukamoto T, Flanary JM, Rojas C, Slusher BS, Valiaeva N, Coward JK: Phosphonate and phosphinate analogues of N-acylated gamma-glutamylglutamate. potent inhibitors of glutamate carboxypeptidase II. Bioorg Med Chem Lett. 2002 Aug 19;12(16):2189-92. [PubMed:12127534 ]
  15. Kannan R, Kuhlenkamp JF, Jeandidier E, Trinh H, Ookhtens M, Kaplowitz N: Evidence for carrier-mediated transport of glutathione across the blood-brain barrier in the rat. J Clin Invest. 1990 Jun;85(6):2009-13. [PubMed:1971830 ]
  16. Hagen TM, Aw TY, Jones DP: Glutathione uptake and protection against oxidative injury in isolated kidney cells. Kidney Int. 1988 Jul;34(1):74-81. [PubMed:3172638 ]
  17. Guo H, Yang J, Gallazzi F, Prossnitz ER, Sklar LA, Miao Y: Effect of DOTA position on melanoma targeting and pharmacokinetic properties of 111In-labeled lactam bridge-cyclized alpha-melanocyte stimulating hormone peptide. Bioconjug Chem. 2009 Nov;20(11):2162-8. doi: 10.1021/bc9003475. [PubMed:19817405 ]