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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:butane-1,3-diol
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Accession:CHEBI:52683 term browser browse the term
Definition:A butanediol compound having two hydroxy groups in the 1- and 3-positions.
Synonyms:related_synonym: (RS)-1,3-Butandiol;   1,3-Butandiol;   1,3-Butanediol;   1,3-Butylene glycol;   1,3-Butylenglykol;   1,3-Dihydroxybutane;   1-Methyl-1,3-propanediol;   Formula=C4H10O2;   InChI=1S/C4H10O2/c1-4(6)2-3-5/h4-6H,2-3H2,1H3;   InChIKey=PUPZLCDOIYMWBV-UHFFFAOYSA-N;   Methyltrimethylene glycol;   SMILES=CC(O)CCO;   beta-Butylene glycol
 xref: Beilstein:1718945;   CAS:107-88-0;   Gmelin:2409;   HMDB:HMDB0031320
 xref_mesh: MESH:C028491
 xref: MetaCyc:CPD-12276;   PMID:7455861;   Reaxys:1718945;   Wikipedia:1\,3-Butanediol


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butane-1,3-diol term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Cyp2e1 cytochrome P450, family 2, subfamily e, polypeptide 1 increases activity
increases expression		 ISO 1,3-butylene glycol results in increased activity of CYP2E1 protein
1,3-butylene glycol results in increased expression of CYP2E1 protein		 CTD PMID:2919394 NCBI chr 7:140,343,732...140,354,903
Ensembl chr 7:140,343,652...140,354,900 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 22178
    role 22194
      application 21744
        refrigerant 19189
          butane 94
            butanediol 87
              butane-1,3-diol 1
                (R)-butane-1,3-diol 0
                (S)-butane-1,3-diol 0
                1,3-dihydroxybutan-2-one 0
                3-methoxy-1-butanol 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22178
    subatomic particle 22170
      composite particle 22170
        hadron 22201
          baryon 22170
            nucleon 22170
              atomic nucleus 22170
                atom 22170
                  main group element atom 22104
                    p-block element atom 22104
                      chalcogen 21431
                        oxygen atom 21437
                          oxygen molecular entity 21409
                            hydroxides 20789
                              organic hydroxy compound 19722
                                polyol 11673
                                  diol 3883
                                    butanediols 169
                                      butanediol 87
                                        butane-1,3-diol 1
                                          (R)-butane-1,3-diol 0
                                          (S)-butane-1,3-diol 0
                                          1,3-dihydroxybutan-2-one 0
                                          3-methoxy-1-butanol 0
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