Dataset
![molecular Image]()
Clonazepam
Chemical Info
| InChI | InChI=1S/C15H10ClN3O3/c16-12-4-2-1-3-10(12)15-11-7-9(19(21)22)5-6-13(11)18-14(20)8-17-15/h1-7H,8H2,(H,18,20) |
|---|---|
| SMILES | [O-1][N+1](=O)c(c3)cc(c(c3)2)C(=NCC(=O)N2)c(c1)c(Cl)ccc1 |
| InChI Key | DGBIGWXXNGSACT-UHFFFAOYSA-N |
| Molecular Formula | C15H10ClN3O3 |
| Exact Mass | 315.041 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-WA002954 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T22:36:40.876718 |
| MetadataModified | 2025-02-09T20:25:05.215673 |
| MetadataPublished | 2016-01-19 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 2802 | PubChem |
| PD009568 | ProbesDrugs |
| 260007 | Brenda |
| 5PE9FDE8GB | FDA SRS |
| 14874486 | PubChem: Thomson Pharma |
| 1622-61-3 | ACToR |
| SCHEMBL38899 | SureChEMBL |
| PA449050 | PharmGKB |
| 106955-87-7 | ACToR |
| 535779 | eMolecules |
| clonazepam | DailyMed |
| ZINC000003813003 | ZINC |
| HMDB0015201 | Human Metabolome Database |
| LSM-45776 | LINCS |
| CHEMBL452 | ChEMBL |
| DB01068 | DrugBank |
| 3756 | ChEBI |
| DTXSID1022845 | EPA CompTox Dashboard |
| 703 | DrugCentral |
| 6963 | Guide to Pharmacology |
| 20237370 | NMRShiftDB |
| RO-54023 | clinicaltrials |
| CLONAZEPAM | clinicaltrials |
| RO 5-4023 | clinicaltrials |
| RIVOTRIL | clinicaltrials |
| RO-5-4023 | clinicaltrials |
| KLONOPIN | clinicaltrials |
| CLONAZEPAM | rxnorm |
| KLONOPIN | rxnorm |
| CLONAZEPAM | DailyMed |
| 50019213 | BindingDB |
| CPHNZP | CCDC |
| The data in this table is sourced from UniChem at EBI. | |