Dataset
![molecular Image]()
Anabasine
Chemical Info
| InChI | InChI=1S/C10H14N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h3-4,6,8,10,12H,1-2,5,7H2 |
|---|---|
| SMILES | C1CCC(NC1)C1=CC=CN=C1 |
| InChI Key | MTXSIJUGVMTTMU-UHFFFAOYSA-N |
| Molecular Formula | C10H14N2 |
| Exact Mass | 162.116 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-NaToxAq-NA002057 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T19:15:50.718008 |
| MetadataModified | 2025-02-09T17:17:13.040766 |
| MetadataPublished | 2019-07-31 |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 2181 | PubChem |
| PD063333 | ProbesDrugs |
| 15091234 | PubChem: Thomson Pharma |
| 13078-04-1 | ACToR |
| SCHEMBL117530 | SureChEMBL |
| LSM-4371 | LINCS |
| 25717831 | eMolecules |
| MTBLC28986 | Metabolights |
| HMDB0004350 | Human Metabolome Database |
| 10024561 | NMRShiftDB |
| MCULE-3752998129 | Mcule |
| 28986 | ChEBI |
| C06180 | KEGG Ligand |
| CHEMBL280963 | ChEMBL |
| HY-W052144 | MedChemExpress |
| 50026461 | BindingDB |
| J849.758C | Nikkaji |
| 494679 | eMolecules |
| CB4100643 | ChemicalBook |
| The data in this table is sourced from UniChem at EBI. | |