Dataset
![molecular Image]()
Iproniazid
Chemical Info
| InChI | InChI=1S/C9H13N3O/c1-7(2)11-12-9(13)8-3-5-10-6-4-8/h3-7,11H,1-2H3,(H,12,13) |
|---|---|
| SMILES | CC(C)NNC(=O)c(c1)ccnc1 |
| InChI Key | NYMGNSNKLVNMIA-UHFFFAOYSA-N |
| Molecular Formula | C9H13N3O |
| Exact Mass | 179.106 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-WA002233 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T22:47:23.746014 |
| MetadataModified | 2024-01-11T22:47:23.904506 |
| MetadataPublished | 2016-01-19 |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 29136 | BindingDB |
| 5958 | ChEBI |
| J4.158K | Nikkaji |
| HY-B0886A | MedChemExpress |
| IPRONIAZID | rxnorm |
| CUXKAK | CCDC |
| HMDB0253570 | Human Metabolome Database |
| DTXSID5023168 | EPA CompTox Dashboard |
| ZINC000000001579 | ZINC |
| 1480 | DrugCentral |
| CHEMBL92401 | ChEMBL |
| C11777 | KEGG Ligand |
| DB04818 | DrugBank |
| 44274 | Brenda |
| 163220 | Brenda |
| 8118 | Brenda |
| 5558 | Brenda |
| CB0928533 | ChemicalBook |
| 711451 | eMolecules |
| 3748 | PubChem |
| PD009098 | ProbesDrugs |
| D892HFI3XA | FDA SRS |
| 15195153 | PubChem: Thomson Pharma |
| LSM-5940 | LINCS |
| SCHEMBL4153 | SureChEMBL |
| 54-92-2 | ACToR |
| iproniazid | Atlas |
| The data in this table is sourced from UniChem at EBI. | |