Dataset
![molecular Image]()
Amidopyrine
Chemical Info
| InChI | InChI=1S/C13H17N3O/c1-10-12(14(2)3)13(17)16(15(10)4)11-8-6-5-7-9-11/h5-9H,1-4H3 |
|---|---|
| SMILES | CN(C)C(=C(C)1)C(=O)N(c(c2)cccc2)N(C)1 |
| InChI Key | RMMXTBMQSGEXHJ-UHFFFAOYSA-N |
| Molecular Formula | C13H17N3O |
| Exact Mass | 231.137 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-WA001348 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T22:47:01.851550 |
| MetadataModified | 2024-01-11T22:47:02.002800 |
| MetadataPublished | 2016-01-19 |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| DB01424 | DrugBank |
| CHEMBL288470 | ChEMBL |
| C07539 | KEGG Ligand |
| 537453 | eMolecules |
| PD001715 | ProbesDrugs |
| SCHEMBL26293 | SureChEMBL |
| LSM-20000 | LINCS |
| 15019234 | PubChem: Thomson Pharma |
| 144574-10-7 | ACToR |
| amidopyrine | Selleck |
| 58-15-1 | ACToR |
| 6009 | PubChem |
| AMDPYR | CCDC |
| J2.331K | Nikkaji |
| MCULE-1554715918 | Mcule |
| PA164748135 | PharmGKB |
| 148192 | Brenda |
| HMDB0015493 | Human Metabolome Database |
| CB1476086 | ChemicalBook |
| 160246 | ChEBI |
| 01704YP3MO | FDA SRS |
| 171 | DrugCentral |
| ZINC000000057115 | ZINC |
| 74258 | BindingDB |
| AMINOPYRINE | rxnorm |
| DTXSID7020504 | EPA CompTox Dashboard |
| The data in this table is sourced from UniChem at EBI. | |