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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:15,16-epoxydolabrene
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Accession:CHEBI:141821 term browser browse the term
Definition:A tricyclic diterpenoid that is dolabradiene in which vinyl substituent has undergone oxidation to give the corresponding epoxide.
Synonyms:exact_synonym: (2Xi)-2-[(2S,4aR,4bS,8aS,10aR)-2,4a,8a-trimethyl-8-methylenetetradecahydrophenanthren-2-yl]oxirane
 related_synonym: Formula=C20H32O;   InChI=1S/C20H32O/c1-14-6-5-7-16-19(14,3)9-8-15-12-18(2,17-13-21-17)10-11-20(15,16)4/h15-17H,1,5-13H2,2-4H3/t15-,16-,17?,18+,19-,20-/m1/s1;   InChIKey=MDUIQYUVECBDRX-LBNFNQNDSA-N;   SMILES=[C@@]12([C@]3([C@](CC[C@@]1(C[C@@](CC2)(C)C4CO4)[H])(C(CCC3)=C)C)[H])C
 xref: MetaCyc:CPD-21266;   PMID:29475898


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 221
    chemical entity 221
      molecular entity 221
        main group molecular entity 214
          gas molecular entity 77
            oxirane 4
              epoxide 4
                15,16-epoxydolabrene 0
                  3beta-hydroxy-15,16-epoxydolabrene 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 221
    subatomic particle 221
      composite particle 221
        hadron 221
          baryon 221
            nucleon 221
              atomic nucleus 221
                atom 221
                  main group element atom 214
                    p-block element atom 214
                      carbon group element atom 203
                        carbon atom 202
                          organic molecular entity 202
                            organic molecule 197
                              organic cyclic compound 181
                                organic heterocyclic compound 138
                                  organic heteromonocyclic compound 92
                                    saturated organic heteromonocyclic parent 4
                                      oxirane 4
                                        epoxide 4
                                          15,16-epoxydolabrene 0
                                            3beta-hydroxy-15,16-epoxydolabrene 0
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