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ONTOLOGY REPORT - ANNOTATIONS


Term:alpha-muurolene
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Accession:CHEBI:64797 term browser browse the term
Definition:A sesquiterpene that is 1,2,4a,5,6,8a-hexahydronaphthalene which is substituted at position 1 by an isopropyl group and at positions 4 and 7 by methyl groups (the 1S,4aS,8aR-diastereoisomer).
Synonyms:exact_synonym: (1S,4aS,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene
 related_synonym: (1S,4aS,8aR)-1-isopropyl-4,7-dimethyl-1,2,4a,5,6,8a-hexahydronaphthalene;   Formula=C15H24;   InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h6,9-10,13-15H,5,7-8H2,1-4H3/t13-,14+,15-/m0/s1;   InChIKey=QMAYBMKBYCGXDH-ZNMIVQPWSA-N;   Muurolene;   SMILES=[H][C@@]12C=C(C)CC[C@]1([H])C(C)=CC[C@H]2C(C)C
 xref: CAS:10208-80-7;   MetaCyc:CPD-8798;   PMID:19400802;   PMID:20889795;   Reaxys:2042841


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  CHEBI ontology 19770
    chemical entity 19769
      molecular entity 19767
        polyatomic entity 19679
          molecule 19493
            cyclic compound 19260
              bicyclic compound 16581
                carbobicyclic compound 4555
                  alpha-muurolene 0
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  CHEBI ontology 19770
    subatomic particle 19768
      composite particle 19768
        hadron 19768
          baryon 19768
            nucleon 19768
              atomic nucleus 19768
                atom 19768
                  main group element atom 19655
                    main group molecular entity 19655
                      s-block molecular entity 19398
                        hydrogen molecular entity 19388
                          hydrides 18363
                            organic hydride 17714
                              organic fundamental parent 17714
                                hydrocarbon 17201
                                  terpene 9490
                                    sesquiterpene 2691
                                      alpha-muurolene 0
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