Dataset

Veralipride

This MassBank record with Accession MSBNK-Waters-WA002448 contains the MS mass spectrum of Veralipride with the InChIkey RYJXBGGBZJGVQF-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H25N3O5S/c1-4-7-20-8-5-6-12(20)11-19-17(21)14-9-13(26(18,22)23)10-15(24-2)16(14)25-3/h4,9-10,12H,1,5-8,11H2,2-3H3,(H,19,21)(H2,18,22,23)
SMILES C=CCN(C2)C(CC2)CNC(=O)c(c1)c(OC)c(OC)cc1S(N)(=O)=O
InChI Key RYJXBGGBZJGVQF-UHFFFAOYSA-N
Molecular Formula C17H25N3O5S
Exact Mass 383.151 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-WA002448
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:44:45.850108
MetadataModified 2024-01-11T22:44:46.001267
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
14878094 PubChem: Thomson Pharma
66644-81-3 ACToR
PD014503 ProbesDrugs
CHEMBL2105581 ChEMBL
J19.193K Nikkaji
HMDB0259780 Human Metabolome Database
SCHEMBL237519 SureChEMBL
HY-101797 MedChemExpress
CB6306612 ChemicalBook
2814 DrugCentral
135600 ChEBI
DTXSID6046268 EPA CompTox Dashboard
S7064109UD FDA SRS
VERALIPRIDE rxnorm
47979 PubChem
DB13523 DrugBank
31231963 eMolecules
12013325 PubChem: Drugs of the Future
The data in this table is sourced from UniChem at EBI.