Dataset

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

This MassBank record with Accession MSBNK-Waters-WA001951 contains the MS mass spectrum of Carteolol with the InChIkey LWAFSWPYPHEXKX-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C16H24N2O3/c1-16(2,3)17-9-11(19)10-21-14-6-4-5-13-12(14)7-8-15(20)18-13/h4-6,11,17,19H,7-10H2,1-3H3,(H,18,20)
SMILES OC(CNC(C)(C)C)COc(c2)c(C1)c(cc2)NC(=O)C1
InChI Key LWAFSWPYPHEXKX-UHFFFAOYSA-N
Molecular Formula C16H24N2O3
Exact Mass 292.179 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-WA001951
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 5-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-1H-quinolin-2-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    SCHEMBL24810 SureChEMBL
    HMDB0014662 Human Metabolome Database
    carteolol DailyMed
    PA164768736 PharmGKB
    2583 PubChem
    PD009980 ProbesDrugs
    14849226 PubChem: Thomson Pharma
    51781-06-7 ACToR
    LSM-1541 LINCS
    CHEMBL839 ChEMBL
    DB00521 DrugBank
    C06874 KEGG Ligand
    J13.087G Nikkaji
    7142 Guide to Pharmacology
    520 DrugCentral
    DTXSID3022746 EPA CompTox Dashboard
    8NF31401XG FDA SRS
    OCUPRESS clinicaltrials
    OPC-1085 clinicaltrials
    CARTROL clinicaltrials
    CARTEOLOL HYDROCHLORIDE clinicaltrials
    CARTEOLOL clinicaltrials
    OCUPRESS rxnorm
    CB0268673 ChemicalBook
    CARTEOLOL HYDROCHLORIDE rxnorm
    CARTEOLOL rxnorm
    CARTEOLOL DailyMed
    SCHEMBL23721779 SureChEMBL
    50040065 BindingDB
    3437 ChEBI
    The data in this table is sourced from UniChem at EBI.