Medical & Healthcare
Tooluniverse Chemical Compound Retrieval
Retrieve chemical compound data from PubChem and ChEMBL with disambiguation, cross-referencing, and stereochemistry handling. Use for resolving compound names to SMILES/InChI/CID/ChEMBL IDs (including OPSIN deterministic IUPAC-name-to-structure parsing), fetching molecular properties, distinguishing isomers/stereo forms, and cross-validating identity across databases. Always use English compound names; flags ambiguous queries (e.g., Vitamin D has multiple forms).
- Publisher / source
- mims-harvard/ToolUniverse (found on GitHub top repositories)
- Upstream record
- mims-harvard/ToolUniverse
- Version
- Version 1
- Published
- Publication review
- Approved for publication
- Content fingerprint
8cbe00fb777265a2820252bcba4ebda746a88d370febbe6d7718f2cd54d675dd