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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:1-isopentyl-2,3,4,6-tetramethylbenzene
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Accession:CHEBI:131433 term browser browse the term
Definition:An alkylbenzene that is 1-isopentylbenzene carrying four additional methyl substituents at position 2, 3, 4 and 6.
Synonyms:exact_synonym: 1,2,3,5-tetramethyl-4-(3-methylbutyl)benzene
 related_synonym: 1-(3-methylbutyl)-2,3,4,6-tetramethylbenzene;   Formula=C15H24;   InChI=1S/C15H24/c1-10(2)7-8-15-12(4)9-11(3)13(5)14(15)6/h9-10H,7-8H2,1-6H3;   InChIKey=RVNTZDGMIQFQJI-UHFFFAOYSA-N;   SMILES=C(CC=1C(=C(C(=CC1C)C)C)C)C(C)C
 xref: Chemspider:513113;   Reaxys:6190868


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  CHEBI ontology 909
    role 868
      chemical role 652
        environmental contaminant 158
          benzene 62
            alkylbenzene 62
              1-isopentyl-2,3,4,6-tetramethylbenzene 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 909
    subatomic particle 894
      composite particle 894
        hadron 894
          baryon 894
            nucleon 894
              atomic nucleus 894
                atom 894
                  main group element atom 863
                    main group molecular entity 861
                      s-block molecular entity 746
                        hydrogen molecular entity 733
                          hydrides 354
                            organic hydride 249
                              organic fundamental parent 249
                                hydrocarbon 185
                                  cyclic hydrocarbon 78
                                    monocyclic hydrocarbon 62
                                      annulene 62
                                        aromatic annulene 62
                                          benzene 62
                                            alkylbenzene 62
                                              1-isopentyl-2,3,4,6-tetramethylbenzene 0
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