biothings_get_chem
Retrieves detailed chemical compound information by ID such as InChIKey or PubChem CID, including structural and physical properties.
Instructions
Fetch a specific chemical compound by ID (e.g., InChIKey, PubChem CID).
Retrieves detailed information about a specific chemical compound using its identifier.
**Supported ID formats:**
- InChIKey: "KTUFNOKKBVMGRW-UHFFFAOYSA-N" (Glucose)
- PubChem CID: "5793" (Glucose)
- SMILES: "C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O)O)O)O"
Returns comprehensive chemical information including structural properties, physical properties,
chemical properties, stereochemistry information, and chemical identifiers.
Input Schema
TableJSON Schema
| Name | Required | Description | Default |
|---|---|---|---|
| No | |||
| fields | No | all | |
| chem_id | Yes |
Output Schema
TableJSON Schema
| Name | Required | Description | Default |
|---|---|---|---|
| id | No | Chemical identifier (typically InChIKey) | |
| pubchem | No | Detailed PubChem information | |
| version | No | Version number of the data |