Dataset
![molecular Image]()
Capric acid
Chemical Info
| InChI | InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12) |
|---|---|
| SMILES | CCCCCCCCCC(=O)O |
| InChI Key | GHVNFZFCNZKVNT-UHFFFAOYSA-N |
| Molecular Formula | C10H20O2 |
| Exact Mass | 172.146 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_N103426_9CB7 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T09:30:46.075300 |
| MetadataModified | 2024-01-11T09:30:46.240846 |
| MetadataPublished | 2022-04-09 |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 488851 | eMolecules |
| CHEMBL107498 | ChEMBL |
| C01571 | KEGG Ligand |
| DKA | PDBe |
| DB03600 | DrugBank |
| HY-W015309 | MedChemExpress |
| 2551 | Brenda |
| DECANOIC ACID | rxnorm |
| LMFA01010010 | LipidMaps |
| ZINC000001529229 | ZINC |
| 50239187 | BindingDB |
| DTXSID9021554 | EPA CompTox Dashboard |
| 4921 | Brenda |
| 135373094 | PubChem |
| SCHEMBL20553507 | SureChEMBL |
| CB1669961 | ChemicalBook |
| HMDB0000511 | Human Metabolome Database |
| 15864 | Brenda |
| 121938 | Brenda |
| 136899 | Brenda |
| MTBLC30813 | Metabolights |
| 30813 | ChEBI |
| 124336 | Brenda |
| 121936 | Brenda |
| 121933 | Brenda |
| 52627-73-3 | ACToR |
| PD006780 | ProbesDrugs |
| 334-48-5 | ACToR |
| 4G9EDB6V73 | FDA SRS |
| 15171203 | PubChem: Thomson Pharma |
| 2969 | PubChem |
| ISEPEB | CCDC |
| SCHEMBL2682 | SureChEMBL |
| 10008813 | NMRShiftDB |
| 5532 | Guide to Pharmacology |
| J2.575E | Nikkaji |
| MCULE-3914949169 | Mcule |
| The data in this table is sourced from UniChem at EBI. | |