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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:butan-1-ol
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Accession:CHEBI:28885 term browser browse the term
Definition:A primary alcohol that is butane in which a hydrogen of one of the methyl groups is substituted by a hydroxy group. It it produced in small amounts in humans by the gut microbes.
Synonyms:related_synonym: 1-Butanol;   1-butyl alcohol;   1-hydroxybutane;   BuOH;   Formula=C4H10O;   InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3;   InChIKey=LRHPLDYGYMQRHN-UHFFFAOYSA-N;   SMILES=CCCCO;   n-Butanol;   n-Butylalkohol;   n-butan-1-ol;   n-butyl alcohol;   propyl carbinol
 alt_id: CHEBI:22936;   CHEBI:39632;   CHEBI:612
 xref: Beilstein:969148;   CAS:71-36-3;   DrugBank:DB02145;   Gmelin:25753;   HMDB:HMDB0004327;   KEGG:C06142;   KEGG:D03200
 xref_mesh: MESH:D020001
 xref: MetaCyc:BUTANOL;   PDBeChem:1BO;   PMID:23980702;   PMID:7096503;   PPDB:1309;   Reaxys:969148;   Wikipedia:N-Butanol


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    Path 1
    Term Annotations click to browse term
      CHEBI ontology 19812
        role 19761
          chemical role 19336
            donor 18644
              Bronsted acid 18526
                protic solvent 14701
                  butan-1-ol 5574
                    4-chlorobutanol 0
                    Butyl propionate 0
                    Monobutylphthalate 527
                    butamben + 5
                    butyl 2-(4-\{[5-(trifluoromethyl)pyridin-2-yl]oxy\}phenoxy)propanoate + 2
                    butyl acetate + 0
                    butyl acrylate 0
                    butyl anthranilate 0
                    butyl butanoate 0
                    butyl dec-9-enoate 0
                    butyl formate 0
                    butyl hexanoate 0
                    butyl octanoate 0
                    dibutyl phthalate 4901
                    n-butyl oleate 0
    Path 2
    Term Annotations click to browse term
      CHEBI ontology 19812
        subatomic particle 19811
          composite particle 19811
            hadron 19811
              baryon 19811
                nucleon 19811
                  atomic nucleus 19811
                    atom 19811
                      main group element atom 19708
                        p-block element atom 19708
                          chalcogen 19460
                            oxygen atom 19436
                              oxygen molecular entity 19436
                                hydroxides 19175
                                  organic hydroxy compound 18668
                                    alcohol 15081
                                      primary alcohol 14009
                                        primary fatty alcohol 5625
                                          short-chain primary fatty alcohol 5613
                                            butan-1-ol 5574
                                              4-chlorobutanol 0
                                              Butyl propionate 0
                                              Monobutylphthalate 527
                                              butamben + 5
                                              butyl 2-(4-\{[5-(trifluoromethyl)pyridin-2-yl]oxy\}phenoxy)propanoate + 2
                                              butyl acetate + 0
                                              butyl acrylate 0
                                              butyl anthranilate 0
                                              butyl butanoate 0
                                              butyl dec-9-enoate 0
                                              butyl formate 0
                                              butyl hexanoate 0
                                              butyl octanoate 0
                                              dibutyl phthalate 4901
                                              n-butyl oleate 0
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