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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:aspergillusene B
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Accession:CHEBI:68219 term browser browse the term
Definition:A sesquiterpenoid that is 1-benzofuran substituted by a methyl group at position 3, a 3-methylbutyl group at position 2 and a carboxy group at position 6. An Aspergillus metabolite isolated from the sea fan derived fungus Aspergillus sydowii.
Synonyms:exact_synonym: 3-methyl-2-(3-methylbutyl)-1-benzofuran-6-carboxylic acid
 related_synonym: Formula=C15H18O3;   InChI=1S/C15H18O3/c1-9(2)4-7-13-10(3)12-6-5-11(15(16)17)8-14(12)18-13/h5-6,8-9H,4,7H2,1-3H3,(H,16,17);   InChIKey=PLDCIRZIXZQVGV-UHFFFAOYSA-N;   SMILES=CC(C)CCc1oc2cc(ccc2c1C)C(O)=O
 xref: PMID:21718031;   Reaxys:21708355


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Path 1
Term Annotations click to browse term
  CHEBI ontology 501
    role 498
      biological role 501
        biochemical role 459
          metabolite 447
            eukaryotic metabolite 425
              fungal metabolite 92
                Aspergillus metabolite 15
                  aspergillusene B 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 501
    subatomic particle 498
      composite particle 501
        hadron 501
          baryon 501
            nucleon 501
              atomic nucleus 501
                atom 501
                  main group element atom 491
                    p-block element atom 491
                      carbon group element atom 480
                        carbon atom 479
                          organic molecular entity 479
                            heteroorganic entity 473
                              organochalcogen compound 427
                                organooxygen compound 425
                                  carbon oxoacid 368
                                    carboxylic acid 368
                                      monocarboxylic acid 92
                                        aspergillusene B 0
paths to the root