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hmdb-database - Access human metabolome database for metabolite research

Search, retrieve, and download human metabolite data including chemical properties, biomarker associations, spectra, and pathways.

Tags

Updated: 2026-09-19

Capabilities

Typical Inputs

Typical Outputs

What this skill does

  • Search metabolites by text query
  • Search metabolites by chemical structure
  • Search metabolites by spectral data
  • Retrieve chemical and biological data
  • Download metabolite datasets
  • Query database using R package

Inputs

  • Metabolite names or identifiers
  • Chemical structures or SMILES
  • NMR or MS spectral data
  • Biological specimen types
  • Disease or pathway queries

Outputs

  • Metabolite chemical properties
  • Biomarker and clinical data
  • NMR and MS spectra
  • Metabolic pathway information
  • Downloaded XML, SDF, CSV files

Requirements

  • Internet connection for web access
  • R environment for hmdbQuery package
  • Permission for commercial dataset usage

Source

  • Spec: SKILL.md

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metabolomics
database
metabolite
bioinformatics
cheminformatics
Search metabolites by text query
Search metabolites by chemical structure
Search metabolites by spectral data
Retrieve chemical and biological data
Metabolite names or identifiers
Chemical structures or SMILES
NMR or MS spectral data
Metabolite chemical properties
Biomarker and clinical data
NMR and MS spectra