Dataset

N-alpha-Acetyl-L-Ornithine; EI-B; MS; n TMS; RT: 824.20 s

This MassBank record with Accession MSBNK-GL_Sciences_Inc-GLS00122 contains the MS mass spectrum of N-alpha-Acetyl-L-Ornithine with the InChIkey JRLGPAXAGHMNOL-LURJTMIESA-N.

Chemical Information

molecular Image
InChI InChI=1S/C7H14N2O3/c1-5(10)9-6(7(11)12)3-2-4-8/h6H,2-4,8H2,1H3,(H,9,10)(H,11,12)/t6-/m0/s1
SMILES NCCC[C@H](NC(C)=O)C(O)=O
InChI Key JRLGPAXAGHMNOL-LURJTMIESA-N
Molecular Formula C7H14N2O3
Exact Mass 174.100 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-GL_Sciences_Inc-GLS00122
Version
Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • (2S)-2-acetamido-5-aminopentanoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:16543 chebi
    CHEBI:57805 chebi
    AOR rcsb_pdb
    159460 surechembl
    439232 pubchem
    6992102 pubchem
    PD102023 probes_and_drugs
    11066 brenda
    113986 brenda
    12626 brenda
    13368 brenda
    164153 brenda
    173850 brenda
    179439 brenda
    183761 brenda
    184364 brenda
    185709 brenda
    20100 brenda
    2570 brenda
    4293 brenda
    51817 brenda
    AOR - Ideal conformer pdbe
    HMDB0003357 hmdb
    Molport-020-004-708 molport
    The data in this table is sourced from UniChem at EBI.