Dataset

L-Glutamate, Glu, 1-Aminopropane-1,3-dicarboxylic acid, Glutacid, Glusate, L-1-Aminopropane-1,3-dicarboxylic Acid, L-Glutamic acid, Aciglut, Glutaminol, (S)-2-Aminopentanedioic acid, alpha-Glutamic acid, L-alpha-Aminoglutaric Acid, (2S)-2-aminopentanedioic acid, Glutaton; LC-ESI-QTOF; MS2

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PT102720 contains the MS2 mass spectrum of L-Glutamate, Glu, 1-Aminopropane-1,3-dicarboxylic acid, Glutacid, Glusate, L-1-Aminopropane-1,3-dicarboxylic Acid, L-Glutamic acid, Aciglut, Glutaminol, (S)-2-Aminopentanedioic acid, alpha-Glutamic acid, L-alpha-Aminoglutaric Acid, (2S)-2-aminopentanedioic acid, Glutaton with the InChIkey WHUUTDBJXJRKMK-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)
SMILES C(CC(=O)O)C(C(=O)O)N
InChI Key WHUUTDBJXJRKMK-UHFFFAOYSA-N
Molecular Formula C5H9NO4
Exact Mass 147.130 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PT102720
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MetadataPublished 2008-07-25
Related Molecule
  • 2-aminopentanedioic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    611 PubChem
    57397101 PubChem
    PD074297 ProbesDrugs
    15146799 PubChem: Thomson Pharma
    19285-83-7 ACToR
    617-65-2 ACToR
    56-86-0 ACToR
    6893-26-1 ACToR
    498263 eMolecules
    CB5116317 ChemicalBook
    HMDB0060475 Human Metabolome Database
    56960 Brenda
    96319 Brenda
    48295 Brenda
    MTBLC18237 Metabolights
    10016967 NMRShiftDB
    SCHEMBL2201 SureChEMBL
    MCULE-4203507491 Mcule
    C00302 KEGG Ligand
    18237 ChEBI
    HY-W041895 MedChemExpress
    61LJO5I15S FDA SRS
    DTXSID0046987 EPA CompTox Dashboard
    50002371 BindingDB
    J5.177B Nikkaji
    CADVUY CCDC
    The data in this table is sourced from UniChem at EBI.