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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term:3-sulfopropanediol
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Accession:CHEBI:77267 term browser browse the term
Definition:An alkanesulfonic acid obtained by the formal substitution of one of the methyl hydrogens of propane-1,2-diol by a sulfonic acid group.
Synonyms:exact_synonym: 2,3-dihydroxypropane-1-sulfonic acid
 related_synonym: 2,3-Dihydroxy-1-propanesulfonic acid;   2,3-Dihydroxypropanesulphonic acid;   Formula=C3H8O5S;   InChI=1S/C3H8O5S/c4-1-3(5)2-9(6,7)8/h3-5H,1-2H2,(H,6,7,8);   InChIKey=YPFUJZAAZJXMIP-UHFFFAOYSA-N;   SMILES=OCC(O)CS(O)(=O)=O
 xref: CAS:10296-76-1;   MetaCyc:2-3-dihydroxypropane-1-sulfonate;   Reaxys:1763745
 cyclic_relationship: is_conjugate_acid_of CHEBI:77138

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  CHEBI ontology 0
    role 0
      biological role 0
        biochemical role 0
          metabolite 0
            3-sulfopropanediol 0
              (2R)-3-sulfopropanediol 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      chalcogen 0
                        oxygen atom 0
                          oxygen molecular entity 0
                            hydroxides 0
                              oxoacid 0
                                chalcogen oxoacid 0
                                  sulfur oxoacid 0
                                    sulfonic acid 0
                                      sulfo group 0
                                        organosulfonic acid 0
                                          alkanesulfonic acid 0
                                            3-sulfopropanediol 0
                                              (2R)-3-sulfopropanediol 0
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