Dataset
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Maprotiline
Chemical Info
| InChI | InChI=1S/C20H23N/c1-21-14-6-12-20-13-11-15(16-7-2-4-9-18(16)20)17-8-3-5-10-19(17)20/h2-5,7-10,15,21H,6,11-14H2,1H3 |
|---|---|
| SMILES | CNCCCC(C3)(c21)c(c4)c(ccc4)C(C3)c(cccc2)1 |
| InChI Key | QSLMDECMDJKHMQ-UHFFFAOYSA-N |
| Molecular Formula | C20H23N |
| Exact Mass | 277.183 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-WA002084 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T22:35:11.170636 |
| MetadataModified | 2025-02-09T20:21:39.814654 |
| MetadataPublished | 2016-01-19 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| MAPROTILINE | DailyMed |
| MAPROTILINE | rxnorm |
| MAPROTILINE HYDROCHLORIDE | rxnorm |
| MAPROTILINE HYDROCHLORIDE | clinicaltrials |
| LUDIOMIL | clinicaltrials |
| MAPROTILINE | clinicaltrials |
| 35228 | BindingDB |
| DTXSID7045029 | EPA CompTox Dashboard |
| 50101973 | BindingDB |
| 1634 | DrugCentral |
| ZINC000001530688 | ZINC |
| J9.818C | Nikkaji |
| 6690 | ChEBI |
| C07107 | KEGG Ligand |
| CHEMBL21731 | ChEMBL |
| 2402 | Guide to Pharmacology |
| DB00934 | DrugBank |
| 902085 | eMolecules |
| PD009633 | ProbesDrugs |
| 2U1W68TROF | FDA SRS |
| LSM-2043 | LINCS |
| 14775197 | PubChem: Thomson Pharma |
| 10262-69-8 | ACToR |
| PA450322 | PharmGKB |
| SCHEMBL33993 | SureChEMBL |
| 34575 | Brenda |
| HMDB0015069 | Human Metabolome Database |
| maprotiline | DailyMed |
| 4011 | PubChem |
| The data in this table is sourced from UniChem at EBI. | |