Dataset

Vigabatrin; LC-ESI-Q; MS; POS; 15 V

This MassBank record with Accession MSBNK-Waters-WA000442 contains the MS mass spectrum of Vigabatrin with the InChIkey PJDFLNIOAUIZSL-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C6H11NO2/c1-2-5(7)3-4-6(8)9/h2,5H,1,3-4,7H2,(H,8,9)
SMILES C=CC(N)CCC(O)=O
InChI Key PJDFLNIOAUIZSL-UHFFFAOYSA-N
Molecular Formula C6H11NO2
Exact Mass 129.079 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-Waters-WA000442
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 4-aminohex-5-enoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    vigabatrin DailyMed
    213168 Brenda
    CB1285620 ChemicalBook
    3140 Brenda
    23509 Brenda
    91632 Brenda
    91636 Brenda
    HMDB0015212 Human Metabolome Database
    25202592 PubChem
    SCHEMBL26714 SureChEMBL
    5665 PubChem
    PD002625 ProbesDrugs
    63638 ChEBI
    LSM-4959 LINCS
    60643-86-9 ACToR
    74046-07-4 ACToR
    PA10231 PharmGKB
    15194489 PubChem: Thomson Pharma
    595429 eMolecules
    VIGABATRIN clinicaltrials
    SABRIL clinicaltrials
    GR120KRT6K FDA SRS
    HY-15399 MedChemExpress
    DTXSID4041153 EPA CompTox Dashboard
    2819 DrugCentral
    4821 Guide to Pharmacology
    J82.341D Nikkaji
    50118886 BindingDB
    VIGABATRIN DailyMed
    SABRIL rxnorm
    VIGABATRIN rxnorm
    CPP-109 clinicaltrials
    CHEMBL89598 ChEMBL
    12012774 PubChem: Drugs of the Future
    C07500 KEGG Ligand
    DB01080 DrugBank
    The data in this table is sourced from UniChem at EBI.