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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		 EXP 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 1:195,840,330...195,850,728
Ensembl chr 1:195,840,058...195,864,023 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19811
    role 19818
      application 19630
        refrigerant 18220
          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 19811
    subatomic particle 19809
      composite particle 19809
        hadron 19840
          baryon 19809
            nucleon 19809
              atomic nucleus 19809
                atom 19809
                  main group element atom 19759
                    p-block element atom 19759
                      chalcogen 19515
                        oxygen atom 19520
                          oxygen molecular entity 19490
                            hydroxides 19300
                              organic hydroxy compound 18928
                                polyol 11702
                                  diol 3915
                                    butanediols 168
                                      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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