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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:4-Phenylbutyl glucosinolate
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Accession:CHEBI:169658 term browser browse the term
Synonyms:exact_synonym: [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-5-phenyl-N-sulooxypentanimidothioate
 related_synonym: Formula=C17H25NO9S2;   InChI=1S/C17H25NO9S2/c19-10-12-14(20)15(21)16(22)17(26-12)28-13(18-27-29(23,24)25)9-5-4-8-11-6-2-1-3-7-11/h1-3,6-7,12,14-17,19-22H,4-5,8-10H2,(H,23,24,25)/b18-13+;   InChIKey=PJZFULXMEGMUDK-QGOAFFKASA-N;   SMILES=S(C1OC(C(O)C(O)C1O)CO)\\C(=N\\OS(O)(=O)=O)\\CCCCC2=CC=CC=C2
 xref: Chemspider:35014573;   HMDB:HMDB0038415

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Path 1
Term Annotations click to browse term
  CHEBI ontology 0
    role 0
      biological role 0
        biochemical role 0
          metabolite 0
            eukaryotic metabolite 0
              plant metabolite 0
                glucosinolate 0
                  alkylglucosinolate 0
                    4-Phenylbutyl glucosinolate 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
                            oxide 0
                              oxoanion 0
                                chalcogen oxoanion 0
                                  sulfur oxoanion 0
                                    glycosinolate 0
                                      glucosinolate 0
                                        alkylglucosinolate 0
                                          4-Phenylbutyl glucosinolate 0
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