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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:hexan-1-ol
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Accession:CHEBI:87393 term browser browse the term
Definition:A primary alcohol that is hexane substituted by a hydroxy group at position 1.
Synonyms:related_synonym: 1-Hexyl alcohol;   1-Hydroxyhexane;   Caproic alcohol;   Formula=C6H14O;   InChI=1S/C6H14O/c1-2-3-4-5-6-7/h7H,2-6H2,1H3;   InChIKey=ZSIAUFGUXNUGDI-UHFFFAOYSA-N;   SMILES=CCCCCCO;   hexanol;   n-Hexyl alcohol
 alt_id: CHEBI:43057;   CHEBI:87439
 xref: CAS:111-27-3;   HMDB:HMDB0012971
 xref_mesh: MESH:C036260
 xref: PDBeChem:HE2;   PMID:24508043;   PMID:24634069;   Reaxys:969167;   Wikipedia:1-Hexanol

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hexan-1-ol term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Akr1b8 aldo-keto reductase family 1, member B8 multiple interactions EXP [AKR1B8 protein co-treated with NADP] affects the oxidation of 1-hexanol CTD PMID:18845131 NCBI chr 4:61,772,064...61,784,637
Ensembl chr 4:61,771,970...61,828,657 		JBrowse link
monohexyl phthalate term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Ppara peroxisome proliferator activated receptor alpha affects binding ISO mono-n-hexyl phthalate binds to PPARA protein CTD PMID:23843199 NCBI chr 7:126,618,872...126,687,282
Ensembl chr 7:126,619,196...126,681,752 		JBrowse link
G Ppard peroxisome proliferator-activated receptor delta affects binding ISO mono-n-hexyl phthalate binds to PPARB protein CTD PMID:23843199 NCBI chr20:7,818,289...7,883,482
Ensembl chr20:7,818,289...7,885,333 		JBrowse link
G Pparg peroxisome proliferator-activated receptor gamma affects binding ISO mono-n-hexyl phthalate binds to PPARG protein CTD PMID:23843199 NCBI chr 4:147,274,055...147,399,383
Ensembl chr 4:147,274,107...147,399,380 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19785
    role 19732
      application 19391
        solvent 16456
          non-polar solvent 8450
            hexane 425
              hexanol 4
                hexan-1-ol 4
                  2-ethylhexyl acetate 0
                  3-methyl-3-sulfanylhexan-1-ol 0
                  hexyl 2-methylbutanoate 0
                  hexyl acetate 0
                  hexyl butyrate 0
                  hexyl hexanoate 0
                  hexyl octanoate 0
                  hexyl propanoate 0
                  monohexyl phthalate 3
Path 2
Term Annotations click to browse term
  CHEBI ontology 19785
    subatomic particle 19782
      composite particle 19782
        hadron 19782
          baryon 19782
            nucleon 19782
              atomic nucleus 19782
                atom 19782
                  main group element atom 19670
                    main group molecular entity 19670
                      s-block molecular entity 19428
                        hydrogen molecular entity 19418
                          hydrides 18685
                            organic hydride 18248
                              organic fundamental parent 18248
                                hydrocarbon 17968
                                  alkane 13683
                                    hexane 425
                                      hexanol 4
                                        hexan-1-ol 4
                                          2-ethylhexyl acetate 0
                                          3-methyl-3-sulfanylhexan-1-ol 0
                                          hexyl 2-methylbutanoate 0
                                          hexyl acetate 0
                                          hexyl butyrate 0
                                          hexyl hexanoate 0
                                          hexyl octanoate 0
                                          hexyl propanoate 0
                                          monohexyl phthalate 3
paths to the root

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