Dataset
![molecular Image]()
Desipramine
Chemical Info
| 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-WA000581 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T22:46:55.077807 |
| MetadataModified | 2024-01-11T22:46:55.225097 |
| MetadataPublished | 2016-01-19 |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| C06943 | KEGG Ligand |
| DB01151 | DrugBank |
| CHEMBL72 | ChEMBL |
| 2399 | Guide to Pharmacology |
| DSM | PDBe |
| 1883445 | eMolecules |
| 812 | DrugCentral |
| ZINC000001530611 | ZINC |
| 35229 | BindingDB |
| DESIPRAMINE | DailyMed |
| DESIPRAMINE | rxnorm |
| DESIPRAMINE HYDROCHLORIDE | rxnorm |
| DTXSID6022896 | EPA CompTox Dashboard |
| DESIPRAMINE | clinicaltrials |
| CB3257775 | ChemicalBook |
| DESIPRAMINE HYDROCHLORIDE | clinicaltrials |
| PERTOFRANE | clinicaltrials |
| NORPRAMIN | clinicaltrials |
| NORPRAMIN | rxnorm |
| 12503 | Brenda |
| 4002 | Brenda |
| 122951 | Brenda |
| 75633 | Brenda |
| 78545 | Brenda |
| HMDB0015282 | Human Metabolome Database |
| desipramine | DailyMed |
| 14774838 | PubChem: Thomson Pharma |
| PA449233 | PharmGKB |
| SCHEMBL34384 | SureChEMBL |
| LSM-3351 | LINCS |
| 50-47-5 | ACToR |
| 2995 | PubChem |
| TG537D343B | FDA SRS |
| PD009775 | ProbesDrugs |
| J8.596K | Nikkaji |
| MCULE-5904286906 | Mcule |
| 47781 | ChEBI |
| The data in this table is sourced from UniChem at EBI. | |