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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:acetochlor ESA
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Accession:CHEBI:83452 term browser browse the term
Definition:An organosulfonic acid that is 2-oxoethanesulfonic acid substituted by an (ethoxymethyl)(2-ethyl-6-methylphenyl)amino group at position 2.
Synonyms:exact_synonym: 2-[(ethoxymethyl)(2-ethyl-6-methylphenyl)amino]-2-oxoethanesulfonic acid
 related_synonym: Formula=C14H21NO5S;   InChI=1S/C14H21NO5S/c1-4-12-8-6-7-11(3)14(12)15(10-20-5-2)13(16)9-21(17,18)19/h6-8H,4-5,9-10H2,1-3H3,(H,17,18,19);   InChIKey=HXAIQOCRALNGKB-UHFFFAOYSA-N;   SMILES=CCOCN(C(=O)CS(O)(=O)=O)c1c(C)cccc1CC;   acetochlor ethanesulfonic acid
 xref: PMID:15543734;   PMID:15888886;   PMID:16793112;   PMID:20206657;   PMID:24691721;   Reaxys:7826743


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  CHEBI ontology 0
    chemical entity 0
      group 0
        inorganic group 0
          sulfo group 0
            organosulfonic acid 0
              acetochlor ESA 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
                                          acetochlor ESA 0
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