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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-(tert-butylamino)-3-(2-tert-butylphenoxy)-2-propanol
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Accession:CHEBI:104027 term browser browse the term
Definition:An alkylbenzene that has formula C17H29NO2.
Synonyms:related_synonym: Formula=C17H29NO2;   InChI=1S/C17H29NO2/c1-16(2,3)14-9-7-8-10-15(14)20-12-13(19)11-18-17(4,5)6/h7-10,13,18-19H,11-12H2,1-6H3;   InChIKey=UHWJPVZFBUZSSG-UHFFFAOYSA-N;   SMILES=CC(C)(C)C1=CC=CC=C1OCC(CNC(C)(C)C)O
 xref: LINCS:LSM-15385


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Path 1
Term Annotations click to browse term
  CHEBI ontology 903
    role 862
      chemical role 647
        environmental contaminant 159
          benzene 63
            alkylbenzene 63
              1-(tert-butylamino)-3-(2-tert-butylphenoxy)-2-propanol 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 903
    subatomic particle 888
      composite particle 888
        hadron 888
          baryon 888
            nucleon 888
              atomic nucleus 888
                atom 888
                  main group element atom 857
                    main group molecular entity 855
                      s-block molecular entity 742
                        hydrogen molecular entity 728
                          hydrides 353
                            organic hydride 250
                              organic fundamental parent 250
                                hydrocarbon 186
                                  cyclic hydrocarbon 79
                                    monocyclic hydrocarbon 63
                                      annulene 63
                                        aromatic annulene 63
                                          benzene 63
                                            alkylbenzene 63
                                              1-(tert-butylamino)-3-(2-tert-butylphenoxy)-2-propanol 0
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