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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:ent-cassa-12,15-dien-2beta,3beta-diol
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Accession:CHEBI:138968 term browser browse the term
Definition:A diterpenoid that is ent-cassa-12,15-diene in which the hydrogens at positions 2beta and 3beta have been replaced by hydroxy groups.
Synonyms:exact_synonym: (2alpha,3alpha,5beta,8alpha,9beta,10alpha,14beta)-13-ethenyl-14-methylpodocarp-12-ene-2,3-diol
 related_synonym: Formula=C20H32O2;   InChI=1S/C20H32O2/c1-6-13-7-9-15-14(12(13)2)8-10-17-19(3,4)18(22)16(21)11-20(15,17)5/h6-7,12,14-18,21-22H,1,8-11H2,2-5H3/t12-,14-,15-,16-,17-,18-,20+/m1/s1;   InChIKey=FMPZXFBEGPUMKF-HUIUSYGUSA-N;   SMILES=[C@@H]1(C([C@@]2([H])CC[C@@]3([C@@H](C(=CC[C@@]3([H])[C@@]2(C[C@H]1O)C)C=C)C)[H])(C)C)O;   ent-cassa-12,15-dien-2beta,3beta-ol
 xref: MetaCyc:CPD-20413;   PMID:25758958


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  CHEBI ontology 26050
    role 25966
      biological role 25945
        biochemical role 25178
          metabolite 25108
            eukaryotic metabolite 24528
              plant metabolite 20921
                ent-cassa-12,15-dien-2beta,3beta-diol 0
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  CHEBI ontology 26050
    subatomic particle 26025
      composite particle 26025
        hadron 26025
          baryon 26025
            nucleon 26025
              atomic nucleus 26025
                atom 26025
                  main group element atom 25850
                    main group molecular entity 25850
                      s-block molecular entity 25171
                        hydrogen molecular entity 24769
                          hydrides 22980
                            organic hydride 21940
                              organic fundamental parent 21940
                                hydrocarbon 21366
                                  terpene 14716
                                    terpenoid 14355
                                      diterpenoid 13539
                                        ent-cassa-12,15-dien-2beta,3beta-diol 0
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