Dataset

Benserazide

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

Chemical Info

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
MetadataCreated 2024-01-11T22:30:13.420652
MetadataModified 2025-02-09T20:27:05.038187
MetadataPublished 2016-01-19
Related Molecule
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.