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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:Ivalin
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Accession:CHEBI:6077 term browser browse the term
Definition:An eudesmane sesquiterpenoid that has formula C15H20O3.
Synonyms:related_synonym: Formula=C15H20O3;   InChI=1S/C15H20O3/c1-8-4-10(16)6-15(3)7-13-11(5-12(8)15)9(2)14(17)18-13/h10-13,16H,1-2,4-7H2,3H3/t10-,11+,12-,13+,15+/m0/s1;   InChIKey=OVIILQQKQPCQTF-GGAZOKNXSA-N;   SMILES=C[C@@]12C[C@H]3OC(=O)C(=C)[C@H]3C[C@H]1C(=C)C[C@H](O)C2
 xref: CAS:5938-03-4;   KEGG:C09488;   KNApSAcK:C00003310



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Path 1
Term Annotations click to browse term
  CHEBI ontology 501
    chemical entity 501
      atom 501
        nonmetal atom 494
          carbon atom 482
            organic molecular entity 482
              isoprenoid 20
                terpenoid 20
                  sesquiterpenoid 2
                    eudesmane sesquiterpenoid 0
                      Ivalin 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 501
    subatomic particle 501
      composite particle 501
        hadron 501
          baryon 501
            nucleon 501
              atomic nucleus 501
                atom 501
                  main group element atom 494
                    main group molecular entity 494
                      s-block molecular entity 438
                        hydrogen molecular entity 437
                          hydrides 368
                            organic hydride 72
                              organic fundamental parent 72
                                hydrocarbon 50
                                  terpene 20
                                    terpenoid 20
                                      sesquiterpenoid 2
                                        eudesmane sesquiterpenoid 0
                                          Ivalin 0
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