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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:1R,4S,6R-1,4-endoperoxy-bisabola-2,10-diene
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Accession:CHEBI:65845 term browser browse the term
Definition:A sesquiterpenoid that is bisabola-2,10-diene substituted by a peroxy group between positions 2 and 10 (the 1R,4S,6R stereoisomer). Isolated from Artemisia stolonifera and Eupatorium rufescens, it exhibits antineoplastic and antiplasmodial activity.
Synonyms:exact_synonym: (1R,4S,7R)-5-methyl-7-[(2S)-6-methylhept-5-en-2-yl]-2,3-dioxabicyclo[2.2.2]oct-5-ene
 related_synonym: Formula=C15H24O2;   InChI=1S/C15H24O2/c1-10(2)6-5-7-11(3)13-9-14-12(4)8-15(13)17-16-14/h6,8,11,13-15H,5,7,9H2,1-4H3/t11-,13+,14-,15-/m0/s1;   InChIKey=LJPSCRDRIZSODI-ATGSNQNLSA-N;   SMILES=[H][C@@]1(C[C@@H]2OO[C@H]1C=C2C)[C@@H](C)CCC=C(C)C
 xref: PMID:10836741;   PMID:17252501



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Term Annotations click to browse term
  CHEBI ontology 19904
    role 19875
      biological role 19873
        biochemical role 19583
          metabolite 19570
            1R,4S,6R-1,4-endoperoxy-bisabola-2,10-diene 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19904
    subatomic particle 19902
      composite particle 19902
        hadron 19902
          baryon 19902
            nucleon 19902
              atomic nucleus 19902
                atom 19902
                  main group element atom 19841
                    main group molecular entity 19841
                      s-block molecular entity 19675
                        hydrogen molecular entity 19657
                          hydrides 19165
                            organic hydride 18712
                              organic fundamental parent 18712
                                hydrocarbon 18462
                                  cyclic hydrocarbon 17249
                                    monocyclic hydrocarbon 6202
                                      cycloalkane 520
                                        bisabolane 0
                                          1R,4S,6R-1,4-endoperoxy-bisabola-2,10-diene 0
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