Dataset

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

This MassBank record with Accession MSBNK-Waters-WA001452 contains the MS mass spectrum of Imidapril with the InChIkey KLZWOWYOHUKJIG-BPUTZDHNSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C20H27N3O6/c1-4-29-19(27)15(11-10-14-8-6-5-7-9-14)21-13(2)17(24)23-16(18(25)26)12-22(3)20(23)28/h5-9,13,15-16,21H,4,10-12H2,1-3H3,(H,25,26)/t13-,15-,16-/m0/s1
SMILES CCOC(=O)C(CCc(c2)cccc2)NC(C)C(=O)N(C(=O)1)C(C(O)=O)CN(C)1
InChI Key KLZWOWYOHUKJIG-BPUTZDHNSA-N
Molecular Formula C20H27N3O6
Exact Mass 405.190 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-WA001452
Version
Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
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    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
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    HMDB0041907 Human Metabolome Database
    40466903 PubChem
    SCHEMBL34098 SureChEMBL
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    BW7H1TJS22 FDA SRS
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    89371-37-9 ACToR
    6843155 eMolecules
    CHEMBL317094 ChEMBL
    CB81009271 ChemicalBook
    1424 DrugCentral
    IMIDAPRIL rxnorm
    IMIDAPRIL clinicaltrials
    DTXSID2048242 EPA CompTox Dashboard
    50020400 BindingDB
    135654 ChEBI
    J325.987K Nikkaji
    6377 Guide to Pharmacology
    The data in this table is sourced from UniChem at EBI.