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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 20965
    role 20946
      biological role 20944
        biochemical role 19953
          metabolite 19880
            eukaryotic metabolite 19702
              fungal metabolite 17872
                Penicillium metabolite 1861
                  3-(hydroxymethyl)-6-[4-(3-methylbut-2-enyloxy)benzyl]piperazine-2,5-dione 0
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  CHEBI ontology 20965
    subatomic particle 20959
      composite particle 20959
        hadron 20959
          baryon 20959
            nucleon 20959
              atomic nucleus 20959
                atom 20959
                  main group element atom 20796
                    p-block element atom 20796
                      carbon group element atom 20536
                        carbon atom 20512
                          organic molecular entity 20512
                            organic group 19164
                              organic divalent group 19154
                                organodiyl group 19154
                                  carbonyl group 19124
                                    carbonyl compound 19124
                                      ketone 16240
                                        cyclic ketone 13493
                                          3-(hydroxymethyl)-6-[4-(3-methylbut-2-enyloxy)benzyl]piperazine-2,5-dione 0
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