Dataset
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Metoprolol
Chemical Info
| InChI | InChI=1S/C15H25NO3/c1-12(2)16-10-14(17)11-19-15-6-4-13(5-7-15)8-9-18-3/h4-7,12,14,16-17H,8-11H2,1-3H3 |
|---|---|
| SMILES | COCCc(c1)ccc(OCC(O)CNC(C)C)c1 |
| InChI Key | IUBSYMUCCVWXPE-UHFFFAOYSA-N |
| Molecular Formula | C15H25NO3 |
| Exact Mass | 267.183 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-WA001247 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T22:49:21.430097 |
| MetadataModified | 2024-01-11T22:49:21.618481 |
| MetadataPublished | 2016-01-19 |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| DB00264 | DrugBank |
| C07202 | KEGG Ligand |
| CHEMBL13 | ChEMBL |
| 6904 | ChEBI |
| 553 | Guide to Pharmacology |
| 902124 | eMolecules |
| PD010136 | ProbesDrugs |
| PA450480 | PharmGKB |
| metoprolol | Atlas |
| 14799183 | PubChem: Thomson Pharma |
| 51384-51-1 | ACToR |
| SCHEMBL4093 | SureChEMBL |
| 37350-58-6 | ACToR |
| LSM-1259 | LINCS |
| 4171 | PubChem |
| MolPort-005-938-039 | MolPort |
| CB4165974 | ChemicalBook |
| CB82630403 | ChemicalBook |
| metoprolol | DailyMed |
| CB1165973 | ChemicalBook |
| HMDB0001932 | Human Metabolome Database |
| 151880 | Brenda |
| 114656 | Brenda |
| 1786 | DrugCentral |
| METOPROLOL TARTRATE | rxnorm |
| GEB06NHM23 | FDA SRS |
| BELOC | clinicaltrials |
| HY-17503 | MedChemExpress |
| CGP-2175 | clinicaltrials |
| LOPRESSOR | clinicaltrials |
| LOPRESOR | clinicaltrials |
| SELOZOK | clinicaltrials |
| SELOKEN-ZOK | clinicaltrials |
| SELOKEN | clinicaltrials |
| BETALOC | clinicaltrials |
| METOPROLOL | clinicaltrials |
| METOPROLOL TARTRATE | clinicaltrials |
| METOPROLOL SUCCINATE | clinicaltrials |
| METOPROLOL FUMARATE | clinicaltrials |
| TOPROL-XL | clinicaltrials |
| METOPROLOL | DailyMed |
| TOPROL | rxnorm |
| TOPROL | clinicaltrials |
| METOPROLOL FUMARATE | rxnorm |
| METOPROLOL SUCCINATE | rxnorm |
| LOPRESSOR | rxnorm |
| METOPROLOL | rxnorm |
| DTXSID2023309 | EPA CompTox Dashboard |
| MCULE-7999715986 | Mcule |
| J31.137E | Nikkaji |
| 25756 | BindingDB |
| The data in this table is sourced from UniChem at EBI. | |