Dataset
![molecular Image]()
Kainic acid
Chemical Info
| InChI | InChI=1S/C10H15NO4/c1-5(2)7-4-11-9(10(14)15)6(7)3-8(12)13/h6-7,9,11H,1,3-4H2,2H3,(H,12,13)(H,14,15)/t6-,7+,9-/m0/s1 |
|---|---|
| SMILES | CC(=C)[C@H]1CN[C@@H]([C@H]1CC(O)=O)C(O)=O |
| InChI Key | VLSMHEGGTFMBBZ-OOZYFLPDSA-N |
| Molecular Formula | C10H15NO4 |
| Exact Mass | 213.233 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-PR300704 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T19:58:34.309063 |
| MetadataModified | 2025-02-09T18:33:18.087835 |
| MetadataPublished | 2019-03-28 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| CB2351306 | ChemicalBook |
| HY-N2309 | MedChemExpress |
| 50002369 | BindingDB |
| 3201 | DrugCentral |
| J9.244D | Nikkaji |
| DTXSID7040526 | EPA CompTox Dashboard |
| CHEMBL275040 | ChEMBL |
| C12819 | KEGG Ligand |
| KAI | PDBe |
| 31746 | ChEBI |
| ZINC000003995575 | ZINC |
| MTBLC31746 | Metabolights |
| 30102 | Brenda |
| SCHEMBL15777 | SureChEMBL |
| 10017620 | NMRShiftDB |
| 10255 | PubChem |
| 44338126 | PubChem |
| PD002700 | ProbesDrugs |
| kainate | Atlas |
| 15220270 | PubChem: Thomson Pharma |
| SIV03811UC | FDA SRS |
| 487-79-6 | ACToR |
| 59905-23-6 | ACToR |
| 16167740 | PubChem: Thomson Pharma |
| kainic acid | Atlas |
| 1934130 | eMolecules |
| The data in this table is sourced from UniChem at EBI. | |