Dataset

Tolbutamide

This MassBank record with Accession MSBNK-Waters-WA002502 contains the MS mass spectrum of Tolbutamide with the InChIkey JLRGJRBPOGGCBT-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H18N2O3S/c1-3-4-9-13-12(15)14-18(16,17)11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3,(H2,13,14,15)
SMILES CCCCNC(=O)NS(=O)(=O)c(c1)ccc(C)c1
InChI Key JLRGJRBPOGGCBT-UHFFFAOYSA-N
Molecular Formula C12H18N2O3S
Exact Mass 270.104 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-WA002502
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:50:34.001558
MetadataModified 2024-01-11T22:50:34.167365
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
TOLBUTAMIDE DailyMed
TOLBUTAMIDE rxnorm
TOLBUTAMIDE SODIUM rxnorm
TOLBUTAMIDE clinicaltrials
HY-B0401 MedChemExpress
50027886 BindingDB
2696 DrugCentral
ZINC000001530703 ZINC
6848 Guide to Pharmacology
J1.406K Nikkaji
ZZZPUS CCDC
DTXSID8021359 EPA CompTox Dashboard
DB01124 DrugBank
C07148 KEGG Ligand
27999 ChEBI
SAM002554936 NIH Clinical Collection
CHEMBL782 ChEMBL
9280 Brenda
MTBLC27999 Metabolights
CB4709039 ChemicalBook
tolbutamide DailyMed
HMDB0015256 Human Metabolome Database
15197366 PubChem: Thomson Pharma
60020895 NMRShiftDB
PD001726 ProbesDrugs
tolbutamide Atlas
982XCM1FOI FDA SRS
tolbutamide Selleck
tolbutamide Recon
100735-34-0 ACToR
64-77-7 ACToR
SCHEMBL15918 SureChEMBL
PA451718 PharmGKB
LSM-3907 LINCS
5505 PubChem
MCULE-9720356859 Mcule
511449 eMolecules
The data in this table is sourced from UniChem at EBI.