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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 1:213,511,892...213,522,195
Ensembl chr 1:213,511,874...213,535,542
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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19786
    role 19732
      application 19423
        refrigerant 17481
          butane 73
            butanediol 66
              butane-1,3-diol 1
                (R)-butane-1,3-diol 0
                (S)-butane-1,3-diol 0
                1,3-dihydroxybutan-2-one 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19786
    subatomic particle 19784
      composite particle 19784
        hadron 19784
          baryon 19784
            nucleon 19784
              atomic nucleus 19784
                atom 19784
                  main group element atom 19675
                    p-block element atom 19675
                      chalcogen 19413
                        oxygen atom 19378
                          oxygen molecular entity 19378
                            hydroxides 19103
                              organic hydroxy compound 18667
                                polyol 8069
                                  diol 3320
                                    butanediols 150
                                      butanediol 66
                                        butane-1,3-diol 1
                                          (R)-butane-1,3-diol 0
                                          (S)-butane-1,3-diol 0
                                          1,3-dihydroxybutan-2-one 0
paths to the root