Dataset

Bepridil

This MassBank record with Accession MSBNK-Waters-WA001790 contains the MS mass spectrum of Bepridil with the InChIkey UIEATEWHFDRYRU-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C24H34N2O/c1-21(2)19-27-20-24(25-15-9-10-16-25)18-26(23-13-7-4-8-14-23)17-22-11-5-3-6-12-22/h3-8,11-14,21,24H,9-10,15-20H2,1-2H3
SMILES CC(C)COCC(CN(Cc(c3)cccc3)c(c2)cccc2)N(C1)CCC1
InChI Key UIEATEWHFDRYRU-UHFFFAOYSA-N
Molecular Formula C24H34N2O
Exact Mass 366.267 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-WA001790
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:48:17.017507
MetadataModified 2025-02-09T20:22:17.491210
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
VASCOR clinicaltrials
BEPRIDIL HYDROCHLORIDE clinicaltrials
UNICORDIUM clinicaltrials
CERM-1978 clinicaltrials
CERM 1978 clinicaltrials
CORDIUM clinicaltrials
BEPRIDIL clinicaltrials
BEPADIN clinicaltrials
2351 PubChem
PD009942 ProbesDrugs
LSM-1898 LINCS
14755108 PubChem: Thomson Pharma
SCHEMBL34412 SureChEMBL
PA164754755 PharmGKB
64706-54-3 ACToR
66183 Brenda
HMDB0015374 Human Metabolome Database
755BO701MA FDA SRS
CB5212202 ChemicalBook
MCULE-3001828285 Mcule
DTXSID3022663 EPA CompTox Dashboard
342 DrugCentral
J19.767J Nikkaji
J558.970C Nikkaji
78577 BindingDB
229199 Brenda
229198 Brenda
BEPRIDIL HYDROCHLORIDE rxnorm
BEPRIDIL rxnorm
DB01244 DrugBank
C06847 KEGG Ligand
CHEMBL1008 ChEMBL
3061 ChEBI
2337 Guide to Pharmacology
The data in this table is sourced from UniChem at EBI.