Dataset

Benserazide; LC-ESI-Q; MS; POS; 30 V

This MassBank record with Accession MSBNK-Waters-WA001797 contains the MS mass spectrum of Benserazide with the InChIkey BNQDCRGUHNALGH-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10H15N3O5/c11-6(4-14)10(18)13-12-3-5-1-2-7(15)9(17)8(5)16/h1-2,6,12,14-17H,3-4,11H2,(H,13,18)
SMILES OCC(N)C(=O)NNCc(c1)c(O)c(O)c(O)c1
InChI Key BNQDCRGUHNALGH-UHFFFAOYSA-N
Molecular Formula C10H15N3O5
Exact Mass 257.101 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-WA001797
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 2-amino-3-hydroxy-N'-[(2,3,4-trihydroxyphenyl)methyl]propanehydrazide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    2327 PubChem
    15094804 PubChem: Thomson Pharma
    PD013354 ProbesDrugs
    SCHEMBL34522 SureChEMBL
    benserazide Atlas
    LSM-5097 LINCS
    322-35-0 ACToR
    64187 ChEBI
    1935102 eMolecules
    PA165360203 PharmGKB
    96905 Brenda
    147310 Brenda
    DB12783 DrugBank
    SCHEMBL20509005 SureChEMBL
    BENSERAZIDE rxnorm
    BENSERAZIDE clinicaltrials
    RO 4-4602 clinicaltrials
    RO-4-4602 clinicaltrials
    10586 Brenda
    49122 BindingDB
    DTXSID9022651 EPA CompTox Dashboard
    314 DrugCentral
    5150 Guide to Pharmacology
    J30.692D Nikkaji
    HMDB0248960 Human Metabolome Database
    762OS3ZEJU FDA SRS
    96907 Brenda
    CB3384419 ChemicalBook
    CHEMBL1096979 ChEMBL
    The data in this table is sourced from UniChem at EBI.