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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:toluene
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Accession:CHEBI:17578 term browser browse the term
Definition:The simplest member of the class toluenes consisting of a benzene core which bears a single methyl substituent.
Synonyms:related_synonym: Formula=C7H8;   InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3;   InChIKey=YXFVVABEGXRONW-UHFFFAOYSA-N;   SMILES=Cc1ccccc1;   Toluen;   Toluol;   methylbenzene;   phenylmethane
 alt_id: CHEBI:15248;   CHEBI:27022;   CHEBI:44023;   CHEBI:9624
 xref: Beilstein:635760;   CAS:108-88-3;   DrugBank:DB01900;   Gmelin:2456;   KEGG:C01455
 xref_mesh: MESH:D014050
 xref: PDBeChem:MBN;   PMID:11182169;   PMID:11314682;   PMID:11846266;   PMID:11991009;   PMID:12062755;   PMID:12213539;   PMID:12237258;   PMID:12784113;   PMID:12876426;   PMID:14512097;   PMID:14559343;   PMID:14605898;   PMID:15015825;   PMID:15019953;   PMID:15119846;   PMID:15193425;   PMID:15542760;   PMID:15567510;   PMID:15695158;   PMID:15796064;   PMID:16316648;   PMID:16348226;   PMID:16601996;   PMID:17145141;   PMID:17175136;   PMID:17497535;   PMID:17725881;   PMID:18397809;   PMID:18832024;   PMID:19261054;   PMID:19384711;   PMID:19429395;   PMID:19635754;   PMID:19765629;   PMID:19825861;   PMID:19928203;   PMID:19969016;   PMID:20347282;   PMID:20837561;   PMID:21430649;   PMID:21655021;   PMID:21731073;   PMID:21802510;   PMID:21840036;   Reaxys:635760;   UM-BBD_compID:c0114;   Wikipedia:Toluene


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Your selection has 3174 annotated objects. The maximum number of objects that can be shown is 2000. The list is too large to display.

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    • Term paths to the root
    Path 1
    Term Annotations click to browse term
      CHEBI ontology 19812
        role 19784
          chemical role 19418
            fuel additive 3182
              toluene 3174
                2,6-diaminotoluene 42
                2-methyl-1,4-phenylenediamine + 2
                benzyl group + 2577
                benzyl thiol 0
                thiobenzaldehyde 0
    Path 2
    Term Annotations click to browse term
      CHEBI ontology 19812
        subatomic particle 19810
          composite particle 19810
            hadron 19810
              baryon 19810
                nucleon 19810
                  atomic nucleus 19810
                    atom 19810
                      main group element atom 19755
                        main group molecular entity 19755
                          s-block molecular entity 19605
                            hydrogen molecular entity 19595
                              hydrides 19072
                                organic hydride 18667
                                  organic fundamental parent 18667
                                    hydrocarbon 18414
                                      cyclic hydrocarbon 17223
                                        monocyclic hydrocarbon 6094
                                          annulene 5745
                                            aromatic annulene 5745
                                              benzene 5745
                                                alkylbenzene 3442
                                                  methylbenzene 3307
                                                    toluene 3174
                                                      2,6-diaminotoluene 42
                                                      2-methyl-1,4-phenylenediamine + 2
                                                      benzyl group + 2577
                                                      benzyl thiol 0
                                                      thiobenzaldehyde 0
    paths to the root