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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:5-hydroxymethylfurfural
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Accession:CHEBI:412516 term browser browse the term
Definition:A member of the class of furans that is furan which is substituted at positions 2 and 5 by formyl and hydroxymethyl substituents, respectively. Virtually absent from fresh foods, it is naturally generated in sugar-containing foods during storage, and especially by drying or cooking. It is the causative component in honey that affects the presystemic metabolism and pharmacokinetics of GZ in-vivo.
Synonyms:exact_synonym: 5-(hydroxymethyl)furan-2-carbaldehyde
 related_synonym: 2-Hydroxymethyl-5-furfural;   5-(Hydroxymethyl)-2-furancarbonal;   5-(Hydroxymethyl)-2-furancarboxaldehyde;   5-(Hydroxymethyl)-2-furfuraldehyde;   5-(Hydroxymethyl)furan-2-aldehyde;   5-(Hydroxymethyl)furfural;   5-(Hydroxymethyl)furfurole;   5-HMF;   5-Hydroxymethyl-2-formylfuran;   5-Hydroxymethyl-2-furaldehyde;   5-Hydroxymethyl-2-furancarbaldehyde;   5-Hydroxymethylfuraldehyde;   5-Hydroxymethylfuran-2-aldehyde;   5-Hydroxymethylfurfuraldehyde;   5-Oxymethylfurfurole;   Formula=C6H6O3;   HMF;   Hydroxymethylfurfural;   Hydroxymethylfurfuralaldehyde;   Hydroxymethylfurfuraldehyde;   Hydroxymethylfurfurole;   InChI=1S/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H2;   InChIKey=NOEGNKMFWQHSLB-UHFFFAOYSA-N;   SMILES=[H]C(=O)c1ccc(CO)o1
 alt_id: CHEBI:2077;   CHEBI:42598
 xref: Beilstein:110889;   CAS:67-47-0;   Gmelin:278693;   HMDB:HMDB0034355;   KEGG:C11101;   KNApSAcK:C00029547
 xref_mesh: MESH:C008046
 xref: MetaCyc:CPD-11572;   PDBeChem:FUX;   PMID:1556177;   PMID:20082406;   PMID:20420424;   PMID:21838257;   PMID:22264628;   PMID:22757699;   PMID:22957895;   PMID:23106038;   PMID:24001819;   PMID:24054253;   PMID:24054256;   PMID:24399510;   PMID:24399607;   PMID:24408726;   PMID:24444020;   PMID:24518321;   PMID:25015917;   PMID:25333920;   PMID:25858076;   PMID:25922228;   PMID:28317713;   PMID:28395827;   PMID:2917974;   PMID:6391997;   Patent:GB591858;   Patent:GB600871;   Patent:US2929823;   Patent:US2994645;   Patent:US3066150;   Patent:US3071599;   Reaxys:110889;   Wikipedia:Hydroxymethylfurfural


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          5-hydroxymethylfurfural 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      carboacyl group 0
                                        univalent carboacyl group 0
                                          formyl group 0
                                            aldehyde 0
                                              arenecarbaldehyde 0
                                                5-hydroxymethylfurfural 0
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