Dataset
![molecular Image]()
Harmol
Chemical Info
| InChI | InChI=1S/C12H10N2O/c1-7-12-10(4-5-13-7)9-3-2-8(15)6-11(9)14-12/h2-6,14-15H,1H3 |
|---|---|
| SMILES | CC1=C2NC3=C(C=CC(O)=C3)C2=CC=N1 |
| InChI Key | SATMZMMKDDTOSQ-UHFFFAOYSA-N |
| Molecular Formula | C12H10N2O |
| Exact Mass | 198.225 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by-nc-sa/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR301623 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T20:21:49.834619 |
| MetadataModified | 2025-02-09T18:27:25.942559 |
| MetadataPublished | 2019-03-28 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| CHEMBL14285 | ChEMBL |
| 50047009 | BindingDB |
| J102.018H | Nikkaji |
| LSM-6720 | LINCS |
| CB7360327 | ChemicalBook |
| ZINC000005765036 | ZINC |
| 7PQ075MCA6 | FDA SRS |
| DTXSID10876697 | EPA CompTox Dashboard |
| HMDB0034217 | Human Metabolome Database |
| 20146941 | NMRShiftDB |
| MCULE-1541330566 | Mcule |
| 15017785 | PubChem: Thomson Pharma |
| 192558 | ChEBI |
| PD001187 | ProbesDrugs |
| 136350002 | PubChem: Drugs of the Future |
| 487-03-6 | ACToR |
| SCHEMBL177685 | SureChEMBL |
| HFI | PDBe |
| 1013372 | eMolecules |
| The data in this table is sourced from UniChem at EBI. | |