Dataset

Isoprenaline

This MassBank record with Accession MSBNK-Waters-WA002714 contains the MS mass spectrum of Isoprenaline with the InChIkey JWZZKOKVBUJMES-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C11H17NO3/c1-7(2)12-6-11(15)8-3-4-9(13)10(14)5-8/h3-5,7,11-15H,6H2,1-2H3
SMILES CC(C)NCC(O)c(c1)cc(O)c(O)c1
InChI Key JWZZKOKVBUJMES-UHFFFAOYSA-N
Molecular Formula C11H17NO3
Exact Mass 211.121 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-WA002714
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:48:52.636872
MetadataModified 2024-01-11T22:48:52.814484
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
HMDB0015197 Human Metabolome Database
9595 Brenda
147680 Brenda
136281 Brenda
1682 Brenda
23437 Brenda
isoproterenol DailyMed
114655 Brenda
DTXSID4023175 EPA CompTox Dashboard
L628TT009W FDA SRS
25392 BindingDB
CB0636388 ChemicalBook
ISOPROTERENOL DailyMed
ISOPROTERENOL SULFATE rxnorm
ISOPROTERENOL rxnorm
ISOPROTERENOL HYDROCHLORIDE rxnorm
ISUPREL rxnorm
CB3854910 ChemicalBook
EUSPIRAN clinicaltrials
ISUPREL clinicaltrials
ISOPRENALINE clinicaltrials
ISOPRENALINE HYDROCHLORIDE clinicaltrials
ISOPRENALINE SULFATE clinicaltrials
ISOPROTERENOL clinicaltrials
ISOPROTERENOL HYDROCHLORIDE clinicaltrials
ISOPROTERENOL SULFATE clinicaltrials
AEROLONE clinicaltrials
NOVODRIN clinicaltrials
MEDIHALER-ISO clinicaltrials
1499 DrugCentral
3779 PubChem
14748912 PubChem: Thomson Pharma
PD009570 ProbesDrugs
64317 ChEBI
LSM-4311 LINCS
PA450121 PharmGKB
2964-04-7 ACToR
149-53-1 ACToR
SCHEMBL4165 SureChEMBL
7683-59-2 ACToR
J28.477G Nikkaji
MCULE-6061231962 Mcule
DB01064 DrugBank
CHEMBL434 ChEMBL
536 Guide to Pharmacology
C07056 KEGG Ligand
901993 eMolecules
The data in this table is sourced from UniChem at EBI.