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ONTOLOGY REPORT - ANNOTATIONS


Term:3-(hydroxymethyl)-6-[4-(3-methylbut-2-enyloxy)benzyl]piperazine-2,5-dione
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Accession:CHEBI:68077 term browser browse the term
Definition:A piperazinone that is piperazine-2,5-dione substituted by a hydroxymethyl group at position 3 and a benzyl group at position 6 which in turn is substituted by a prenyloxy group at position 4. It has been isolated from Penicillium chrysogenum.
Synonyms:exact_synonym: 3-(hydroxymethyl)-6-{4-[(3-methylbut-2-en-1-yl)oxy]benzyl}piperazine-2,5-dione
 related_synonym: Formula=C17H22N2O4;   InChI=1S/C17H22N2O4/c1-11(2)7-8-23-13-5-3-12(4-6-13)9-14-16(21)19-15(10-20)17(22)18-14/h3-7,14-15,20H,8-10H2,1-2H3,(H,18,22)(H,19,21);   InChIKey=KRLKPTMEUFJHKD-UHFFFAOYSA-N;   SMILES=CC(C)=CCOc1ccc(CC2NC(=O)C(CO)NC2=O)cc1
 xref: PMID:21381678 "Europe PMC";   Reaxys:21559824 "Reaxys"


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  CHEBI ontology 223
    role 223
      biological role 223
        biochemical role 185
          metabolite 177
            eukaryotic metabolite 156
              fungal metabolite 80
                Penicillium metabolite 1
                  3-(hydroxymethyl)-6-[4-(3-methylbut-2-enyloxy)benzyl]piperazine-2,5-dione 0
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  CHEBI ontology 223
    subatomic particle 223
      composite particle 223
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              atomic nucleus 223
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                            organic group 153
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                                  carbonyl group 152
                                    carbonyl compound 152
                                      ketone 47
                                        cyclic ketone 43
                                          3-(hydroxymethyl)-6-[4-(3-methylbut-2-enyloxy)benzyl]piperazine-2,5-dione 0
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