From: XMetDB: an open access database for xenobiotic metabolism
Name | Description |
---|---|
URI | XMetDB observation URI |
Identifier | XMetDB observation identifier |
Substrate SMILES | SMILES of the substrate structure |
Substrate InChI | InChI of the substrate structure |
Product SMILES | SMILES of the product structure |
Product InChI | InChI of the product structure |
Product amount | The product amount. One of Major, Minor or Unknown |
Experiment type | The experiment. One of Hepatocytes, Microsomes, Enzymes |
Enzyme code | Enzyme code |
Enzyme name | Enzyme name |
UniProt | Enzyme UniProt ID |
Reference | The publication from which the data is taken, either as a DOI or as a plain text reference |
Comment | Free text comment |