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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-14193
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Accession:CHEBI:102847 term browser browse the term
Definition:An indolyl carboxylic acid that has formula C33H37FN4O4.
Synonyms:related_synonym: Formula=C33H37FN4O4;   InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-11-7-8-12-28(27)37(31)4)26-10-6-5-9-23(26)20-42-29(21)18-36(3)33(41)35-25-15-13-24(34)14-16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22+,29-/m1/s1;   InChIKey=HIWUQZOVKTUVHW-UETOGOEVSA-N;   SMILES=C[C@@H]1CN(C(=O)C2=C(C3=CC=CC=C3CO[C@@H]1CN(C)C(=O)NC4=CC=C(C=C4)F)C5=CC=CC=C5N2C)[C@@H](C)CO
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Path 1
Term Annotations click to browse term
  CHEBI ontology 19838
    role 19814
      chemical role 19449
        donor 18910
          Bronsted acid 18791
            oxoacid 18765
              carbon oxoacid 18637
                carboxylic acid 18634
                  indolyl carboxylic acid 3450
                    LSM-14193 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19838
    subatomic particle 19836
      composite particle 19836
        hadron 19836
          baryon 19836
            nucleon 19836
              atomic nucleus 19836
                atom 19836
                  main group element atom 19786
                    p-block element atom 19786
                      carbon group element atom 19734
                        carbon atom 19731
                          organic molecular entity 19731
                            organic molecule 19684
                              organic cyclic compound 19496
                                organic heterocyclic compound 18874
                                  organic heteropolycyclic compound 18299
                                    organic heterobicyclic compound 17233
                                      benzopyrrole 9722
                                        indoles 9411
                                          indolyl carboxylic acid 3450
                                            LSM-14193 0
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