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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:10-deoxygerfelin
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Accession:CHEBI:64412 term browser browse the term
Definition:A member of the class of benzoic acids that is salicylic acid which is substituted at position 6 by a methyl group and at position 4 by a 3-hydroxy-5-methylphenoxy group.
Synonyms:exact_synonym: 2-hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylbenzoic acid
 related_synonym: C-10-deoxy derivative of gerfelin;   C-10-deoxy gerfelin;   C-10-deoxygerfelin;   C10-deoxy derivative of gerfelin;   C10-deoxy gerfelin;   C10-deoxygerfelin;   Formula=C15H14O5;   InChI=1S/C15H14O5/c1-8-3-10(16)6-11(4-8)20-12-5-9(2)14(15(18)19)13(17)7-12/h3-7,16-17H,1-2H3,(H,18,19);   InChIKey=ZJEIMBOWRAUNAN-UHFFFAOYSA-N;   SMILES=Cc1cc(O)cc(Oc2cc(C)c(C(O)=O)c(O)c2)c1
 xref: PMID:20174687;   Reaxys:2663280


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  CHEBI ontology 495
    role 495
      biological role 495
        biochemical role 455
          metabolite 446
            10-deoxygerfelin 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 495
    subatomic particle 495
      composite particle 495
        hadron 495
          baryon 495
            nucleon 495
              atomic nucleus 495
                atom 495
                  main group element atom 488
                    p-block element atom 488
                      carbon group element atom 477
                        carbon atom 476
                          organic molecular entity 476
                            heteroorganic entity 472
                              organochalcogen compound 426
                                organooxygen compound 424
                                  carbon oxoacid 365
                                    carboxylic acid 365
                                      aromatic carboxylic acid 19
                                        benzoic acids 16
                                          10-deoxygerfelin 0
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