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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:LSM-39047
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Accession:CHEBI:127489 term browser browse the term
Definition:An aromatic amine that has formula C25H33FN2O4S.
Synonyms:related_synonym: Formula=C25H33FN2O4S;   InChI=1S/C25H33FN2O4S/c1-5-8-20-11-12-25-23(13-20)32-24(16-27(4)15-21-9-6-7-10-22(21)26)18(2)14-28(19(3)17-29)33(25,30)31/h5-13,18-19,24,29H,14-17H2,1-4H3/t18-,19-,24-/m1/s1;   InChIKey=YOCBOZXTNPBXJL-KHCICDEESA-N;   SMILES=CC=CC1=CC2=C(C=C1)S(=O)(=O)N(C[C@H]([C@H](O2)CN(C)CC3=CC=CC=C3F)C)[C@H](C)CO
 xref: LINCS:LSM-39047


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Term Annotations click to browse term
  CHEBI ontology 26046
    role 25962
      application 25183
        NMR chemical shift reference compound 20306
          ammonia 19961
            organic amino compound 19961
              aromatic amine 16218
                LSM-39047 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26046
    subatomic particle 26021
      composite particle 26021
        hadron 26021
          baryon 26021
            nucleon 26021
              atomic nucleus 26021
                atom 26021
                  main group element atom 25846
                    main group molecular entity 25846
                      s-block molecular entity 25167
                        hydrogen molecular entity 24765
                          hydrides 22977
                            inorganic hydride 20502
                              pnictogen hydride 20443
                                nitrogen hydride 20221
                                  azane 19962
                                    ammonia 19961
                                      organic amino compound 19961
                                        aromatic amine 16218
                                          LSM-39047 0
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