Dataset

Desipramine

This MassBank record with Accession MSBNK-Waters-WA000579 contains the MS mass spectrum of Desipramine with the InChIkey HCYAFALTSJYZDH-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C18H22N2/c1-19-13-6-14-20-17-9-4-2-7-15(17)11-12-16-8-3-5-10-18(16)20/h2-5,7-10,19H,6,11-14H2,1H3
SMILES CNCCCN(c21)c(c3)c(ccc3)CCc(cccc2)1
InChI Key HCYAFALTSJYZDH-UHFFFAOYSA-N
Molecular Formula C18H22N2
Exact Mass 266.178 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-WA000579
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:33:25.763055
MetadataModified 2025-02-09T20:26:02.470616
MetadataPublished 2016-01-19
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
DESIPRAMINE DailyMed
DESIPRAMINE rxnorm
DESIPRAMINE HYDROCHLORIDE rxnorm
NORPRAMIN rxnorm
PERTOFRANE clinicaltrials
DESIPRAMINE clinicaltrials
35229 BindingDB
DESIPRAMINE HYDROCHLORIDE clinicaltrials
NORPRAMIN clinicaltrials
DTXSID6022896 EPA CompTox Dashboard
812 DrugCentral
ZINC000001530611 ZINC
J8.596K Nikkaji
CB3257775 ChemicalBook
12503 Brenda
C06943 KEGG Ligand
DB01151 DrugBank
CHEMBL72 ChEMBL
2399 Guide to Pharmacology
DSM PDBe
desipramine DailyMed
75633 Brenda
HMDB0015282 Human Metabolome Database
122951 Brenda
78545 Brenda
4002 Brenda
47781 ChEBI
MCULE-5904286906 Mcule
14774838 PubChem: Thomson Pharma
PA449233 PharmGKB
SCHEMBL34384 SureChEMBL
LSM-3351 LINCS
50-47-5 ACToR
2995 PubChem
TG537D343B FDA SRS
PD009775 ProbesDrugs
1883445 eMolecules
The data in this table is sourced from UniChem at EBI.