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ONTOLOGY REPORT - ANNOTATIONS
Term:cadiyenol
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Accession:CHEBI:65538 term browser browse the term
Definition:An acetylenic compound that is (8E)-heptadeca-1,8-diene-4,6-diyne substituted by hydroxy group at positions 6 and 15, a methoxy group at position 8 and a (5-methoxy-5-oxopentyl)oxy group at position 7. Isolated from Centella asiatica, it exhibits antineoplastic activity.
Synonyms:exact_synonym: methyl 5-{[(9E)-6,15-dihydroxy-8-methoxyheptadeca-9,16-diene-11,13-diyn-7-yl]oxy}pentanoate
 related_synonym: Formula=C24H36O6;   InChI=1S/C24H36O6/c1-5-7-10-16-21(26)24(30-19-14-13-18-23(27)29-4)22(28-3)17-12-9-8-11-15-20(25)6-2/h6,12,17,20-22,24-26H,2,5,7,10,13-14,16,18-19H2,1,3-4H3/b17-12+;   InChIKey=LCCGCXCFZHBCJT-SFQUDFHCSA-N;   SMILES=CCCCCC(O)C(OCCCCC(=O)OC)C(OC)\\C=C\\C#CC#CC(O)C=C
 xref: PMID:17520525 "Europe PMC";   Reaxys:11222769 "Reaxys"

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  CHEBI ontology 19716
    role 19663
      biological role 19661
        biochemical role 19179
          metabolite 19151
            cadiyenol 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19716
    subatomic particle 19712
      composite particle 19712
        hadron 19712
          baryon 19712
            nucleon 19712
              atomic nucleus 19712
                atom 19712
                  main group element atom 19598
                    p-block element atom 19598
                      chalcogen 19301
                        oxygen atom 19261
                          oxygen molecular entity 19261
                            hydroxides 19013
                              organic hydroxy compound 18571
                                alcohol 14939
                                  aliphatic alcohol 11084
                                    alkyl alcohol 11037
                                      methanol 2951
                                        methyl ester 2942
                                          cadiyenol 0
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