Mcule Lookup Compound
Look up purchasable compounds on Mcule by SMILES, InChIKey, or Mcule ID. Mcule aggregates 30M+ compounds from multiple chemical suppliers. Returns matching Mcule IDs and SMILES structures. Accepts any chemical identifier: SMILES string (e.g., CC(=O)Oc1ccccc1C(=O)O for aspirin), InChIKey (e.g., BSYNRYMUTXBXSQ-UHFFFAOYSA-N), or Mcule ID (e.g., MCULE-3199019536). Use this as the first step to find a compound's Mcule ID, then use Mcule_get_compound for full details. Public endpoint, no auth require…
Overview
Look up purchasable compounds on Mcule by SMILES, InChIKey, or Mcule ID. Mcule aggregates 30M+ compounds from multiple chemical suppliers. Returns matching Mcule IDs and SMILES structures. Accepts any chemical identifier: SMILES string (e.g., CC(=O)Oc1ccccc1C(=O)O for aspirin), InChIKey (e.g., BSYNRYMUTXBXSQ-UHFFFAOYSA-N), or Mcule ID (e.g., MCULE-3199019536). Use this as the first step to find a compound's Mcule ID, then use Mcule_get_compound for full details. Public endpoint, no auth required (rate limit: 10/min).
Schema
JSON Schema the agent (or your API call) must match.
View JSON schemaExpandCollapse
Examples (1)
Default Mcule Lookup Compound call
Public-safe example · rate-limited
Identifiers
- Catalog ID
- tu_Mcule_lookup_compound
- Tool name
- Mcule_lookup_compound
- Added
- 2026-04-30 22:47Z
- Tags
- tooluniverse