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hmdb-database - Access Human Metabolome Database for metabolite searches and information retrieval

Access Human Metabolome Database (220K+ metabolites). Search by name/ID/structure, retrieve chemical properties, biomarker data, NMR/MS spectra, and pathways.

Tags

Updated: 2026-03-26

Capabilities

Typical Inputs

Typical Outputs

What this skill does

  • Search metabolites by name
  • Search metabolites by ID
  • Search metabolites by structure
  • Search metabolites by substructure
  • Search metabolites by molecular weight
  • Search metabolites by SMILES
  • Search metabolites by InChI
  • Search metabolites by spectrum
  • Search metabolites by disease
  • Search metabolites by pathway
  • Search metabolites by specimen type
  • Retrieve chemical properties
  • Retrieve biological information
  • Retrieve clinical data
  • Retrieve spectral data
  • Download metabolite datasets
  • Download protein sequences
  • Download spectra data
  • Download pathway data

Inputs

  • Metabolite name
  • HMDB ID
  • SMILES string
  • InChI string
  • Molecular weight
  • Chemical structure
  • Spectrum data
  • Disease name
  • Pathway name
  • Specimen type

Outputs

  • Chemical properties
  • Biological information
  • Clinical data
  • Spectral data
  • Metabolite dataset files
  • Protein sequence files
  • Pathway information

Requirements

  • Web access to hmdb.ca
  • Internet connection
  • Non-commercial use for free access

Source

  • Spec: SKILL.md

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metabolomics
database
metabolites
chemical compounds
spectroscopy
biomarker discovery
pathway analysis
Search metabolites by name
Search metabolites by ID
Search metabolites by structure
Search metabolites by substructure
Metabolite name
HMDB ID
SMILES string
Chemical properties
Biological information
Clinical data