Dataset
![molecular Image]()
Butamben
Chemical Info
| InChI | InChI=1S/C11H15NO2/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7H,2-3,8,12H2,1H3 |
|---|---|
| SMILES | CCCCOC(=O)c(c1)ccc(N)c1 |
| InChI Key | IUWVALYLNVXWKX-UHFFFAOYSA-N |
| Molecular Formula | C11H15NO2 |
| Exact Mass | 193.110 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-WA001772 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T22:37:37.702113 |
| MetadataModified | 2025-02-09T20:21:07.236823 |
| MetadataPublished | 2016-01-19 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| butamben | DailyMed |
| DB11148 | DrugBank |
| CB9123524 | ChemicalBook |
| 37095 | Brenda |
| MCULE-6283966699 | Mcule |
| SCHEMBL81735 | SureChEMBL |
| 2482 | PubChem |
| PD001588 | ProbesDrugs |
| 15322311 | PubChem: Thomson Pharma |
| LSM-5413 | LINCS |
| 94-25-7 | ACToR |
| EFW857872Q | FDA SRS |
| 476478 | eMolecules |
| BUTYL AMINOBENZOATE PICRATE | clinicaltrials |
| BUTAMBEN | clinicaltrials |
| BUTAMBEN PICRATE | clinicaltrials |
| BUTESIN | clinicaltrials |
| BUTYL AMINOBENZOATE | clinicaltrials |
| CHEMBL127516 | ChEMBL |
| C07875 | KEGG Ligand |
| BUTAMBEN PICRATE | rxnorm |
| 50240094 | BindingDB |
| BUTAMBEN | rxnorm |
| HY-B1430 | MedChemExpress |
| 233779 | Brenda |
| DTXSID7022417 | EPA CompTox Dashboard |
| BUTAMBEN | DailyMed |
| ZINC000001530937 | ZINC |
| J4.698A | Nikkaji |
| HMDB0249473 | Human Metabolome Database |
| EZAVIK | CCDC |
| 3051 | DrugCentral |
| 3231 | ChEBI |
| The data in this table is sourced from UniChem at EBI. | |