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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:(3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one
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Accession:CHEBI:153569 term browser browse the term
Definition:An aromatic ketone that is phloroglucinol in which two of the hydrogens attached to the benzene ring have been replaced by a chloro and hexanoyl groups. It is an intermediate biosynthetic precursor for differentiation-inducing factor 1 (DIF-1) which is a major inducer of stalk cell differentiation.
Synonyms:exact_synonym: 1-(3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one
 related_synonym: 1-(2,4,6-trihydroxy-3-chlorophenyl)-1-hexanone;   1-(3-chloro-2,4,6-trihydroxyphenyl)-1-hexanone;   Cl-THPH;   Formula=C12H15ClO4;   InChI=1S/C12H15ClO4/c1-2-3-4-5-7(14)10-8(15)6-9(16)11(13)12(10)17/h6,15-17H,2-5H2,1H3;   InChIKey=OTRYFPNTAFPSBU-UHFFFAOYSA-N;   SMILES=C(CCCCC)(=O)C1=C(C(=C(C=C1O)O)Cl)O;   chloro-THPH
 xref: PMID:16545913;   PMID:17259634;   PMID:18402932;   PMID:20231486;   PMID:9446571
 cyclic_relationship: is_conjugate_acid_of CHEBI:152555



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  CHEBI ontology 20072
    role 20024
      biological role 20023
        biochemical role 19658
          metabolite 19642
            eukaryotic metabolite 19348
              (3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one 0
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  CHEBI ontology 20072
    subatomic particle 20071
      composite particle 20071
        hadron 20071
          baryon 20071
            nucleon 20071
              atomic nucleus 20071
                atom 20071
                  main group element atom 19971
                    p-block element atom 19971
                      carbon group element atom 19894
                        carbon atom 19887
                          organic molecular entity 19887
                            organic group 18965
                              organic divalent group 18951
                                organodiyl group 18951
                                  carbonyl group 18903
                                    carbonyl compound 18903
                                      ketone 17111
                                        aromatic ketone 12387
                                          (3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one 0
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