GlobalGlobalglobalglobalFILESDFMOLRDFchemicalchemistryOther (Non-Commercial)Oct 10, 20132013-10-10
Dataset
ChemSpider
A free database of chemicals, covering around 26 million compounds integrated from 400 data sources.
About
A free database of chemicals, covering around 26 million compounds integrated from 400 data sources.
The database APIs are free for academic users, or for non-academic non-commercial users. Commercial users may pay a fee but are encouraged to contact the ChemSpider help address (chemspider@rsc.org). The web services require an access token which is provided on request.
Download & API
Simple Searchfile
Search for Chemical
Structure Searchfile
Structure Search
Advanced Searchfile
Advanced Search
Mass Spectrometry API - GetCompressedRecordsSdfsdf
Mass Spectrometry API - Compressed Search Result
Mass Spectrometry API - List data sourcesfile
Mass Spectrometry API - List data sources
Mass Spectrometry API - Extended Chemical Info (auth required)file
Mass Spectrometry API - Extended Chemical Info (auth required)
Mass Spectrometry API - Extended info for multiple chemicals (auth required)file
Mass Spectrometry API - Extended info for multiple chemicals (auth required)
Mass Spectrometry API - Get individual recordmol
Mass Spectrometry API - Get individual record
Mass Spectrometry API - Get recordssdf
Mass Spectrometry API - Get records
Mass Spectrometry API - Search by formula (deprecated)file
Mass Spectrometry API - Search by formula (deprecated)
Mass Spectrometry API - Search by formula (v2)file
Mass Spectrometry API - Search by formula (v2)
Mass Spectrometry API - Search by formula asyncronouslyfile
Mass Spectrometry API - Search by formula asyncronously
Mass Spectrometry API - Search by mass (deprecated)file
Mass Spectrometry API - Search by mass (deprecated)
Mass Spectrometry API - Search by mass (v2)file
Mass Spectrometry API - Search by mass (v2)
Mass Spectrometry API - Search by mass asyncronouslyfile
Mass Spectrometry API - Search by mass asyncronously
Search API - Simple Search (auth required)file
Search API - Simple Search (auth required)
Search API - CSID to Ext (auth required)file
Search API - CSID to Ext (auth required)
Search API - Elements (auth required)file
Search API - Elements (auth required)
Search API - Asynchronous Search (auth required)file
Search API - Asynchronous Search (auth required)
Search API - Asynchronous Search, partial result (auth required)file
Search API - Asynchronous Search, partial result (auth required)
Search API - Get compound's info (auth required)file
Search API - Get compound's info (auth required)
Search API - Get compound's thumbnail (auth required)file
Search API - Get compound's thumbnail (auth required)
Search API - Get data slice's compound ids (auth required)file
Search API - Get data slice's compound ids (auth required)
Search API - Get record's detailsfile
Search API - Get record's details
Search API - Get record's imagefile
Search API - Get record's image
Search API - Intrinsic Properties (auth required)file
Search API - Intrinsic Properties (auth required)
Search API - Search by LASSO (auth required)file
Search API - Search by LASSO (auth required)
Search API - Search by MOL in dataset (auth required)file
Search API - Search by MOL in dataset (auth required)
Search API - Search by MOL (auth required)file
Search API - Search by MOL (auth required)
Search API - Predicted Properties (auth required)file
Search API - Predicted Properties (auth required)
Search API - Similarity Search (auth required)file
Search API - Similarity (auth required)
Search API - Simple Search (auth required)file
Search API - Simple Search (auth required)
Search API - Simple Search by list of chemical IDs (auth required)file
Search API - Simple Search by list of chemical IDs (auth required)
Search API - Structure Search (auth required)file
Search API - Structure Search (auth required)
Search API - Substructure Search (auth required)file
Search API - Substructure Search (auth required)
Spectra API - Gett All Spectra Informationfile
Spectra API - Gett All Spectra Information
Spectra API - Get spectra information for a specific compoundfile
Spectra API - Get spectra information for a specific compound
Spectra API - Get spectra information for several compoundsfile
Spectra API - Get spectra information for a list of chemical IDs
Spectra API - Get spectra information for a chemicalfile
Spectra API - Get spectra information for a chemical
InChI API - CSID to MOL (auth required)file
InChI API - CSID to MOL (auth required)
InChI API - Generate InChIfile
InChI API - Generate InChI
InChI API - Generate InChI, InChIKey and AuxInfofile
InChI API - Generate InChI, InChIKey and AuxInfo
InChI API - Convert InChIKey to ChemSpider IDfile
InChI API - Convert InChIKey to ChemSpider ID
InChI API - Convert InChIKey to InChIfile
InChI API - Convert InChIKey to InChI
InChI API - Convert InChIKey to MOLfile
InChI API - Convert InChIKey to MOL
InChI API - Convert InChIKey to ChemSpider IDfile
InChI API - Convert InChIKey to ChemSpider ID
InChI API - Convert InChI to InChIKeyfile
InChI API - Convert InChI to InChIKey
InChI API - Convert InChI to MOLfile
InChI API - Convert InChI to MOL
InChI API - Convert InChI to SMILESfile
InChI API - Convert InChI to SMILES
InChI API - Check InChIKKet is validfile
InChI API - Check InChIKKet is valid
InChI API - Convert MOL to InChIKeyfile
InChI API - Convert MOL to InChIKey
InChI API - Resolve InChIKey against ChemSpiderfile
InChI API - Resolve InChIKey against ChemSpider
InChI API - Convert SMILES to InChIfile
InChI API - Convert SMILES to InChI
OpenBabel API - Convert between formatsfile
OpenBabel API - Convert between formats
Return Search results as RDFrdf
Search and return results as RDF
Return RDF for a ChemSpider IDrdf
Return RDF for a ChemSpider ID
Sources & license
Sources
License
- Other (Non-Commercial)