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ONTOLOGY REPORT - ANNOTATIONS


Term:2-[4-[[6-ethoxycarbonyl-7-methyl-5-[4-(methylthio)phenyl]-3-oxo-5H-thiazolo[3,2-a]pyrimidin-2-ylidene]methyl]phenoxy]acetic acid
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Accession:CHEBI:91803 term browser browse the term
Definition:A monocarboxylic acid that has formula C26H24N2O6S2.
Synonyms:related_synonym: Formula=C26H24N2O6S2;   InChI=1S/C26H24N2O6S2/c1-4-33-25(32)22-15(2)27-26-28(23(22)17-7-11-19(35-3)12-8-17)24(31)20(36-26)13-16-5-9-18(10-6-16)34-14-21(29)30/h5-13,23H,4,14H2,1-3H3,(H,29,30);   InChIKey=RAHUOJTWCHPLKH-UHFFFAOYSA-N;   SMILES=CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)SC)C(=O)C(=CC4=CC=C(C=C4)OCC(=O)O)S2)C
 xref: LINCS:LSM-1704


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  CHEBI ontology 20965
    role 20946
      chemical role 20277
        donor 19323
          Bronsted acid 19128
            oxoacid 19084
              carbon oxoacid 18817
                carboxylic acid 18804
                  monocarboxylic acid 17989
                    2-[4-[[6-ethoxycarbonyl-7-methyl-5-[4-(methylthio)phenyl]-3-oxo-5H-thiazolo[3,2-a]pyrimidin-2-ylidene]methyl]phenoxy]acetic acid 0
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  CHEBI ontology 20965
    subatomic particle 20959
      composite particle 20959
        hadron 20959
          baryon 20959
            nucleon 20959
              atomic nucleus 20959
                atom 20959
                  main group element atom 20796
                    p-block element atom 20796
                      carbon group element atom 20536
                        carbon atom 20512
                          organic molecular entity 20512
                            organic group 19164
                              organic divalent group 19154
                                organodiyl group 19154
                                  carbonyl group 19124
                                    carbonyl compound 19124
                                      carboxylic acid 18804
                                        monocarboxylic acid 17989
                                          2-[4-[[6-ethoxycarbonyl-7-methyl-5-[4-(methylthio)phenyl]-3-oxo-5H-thiazolo[3,2-a]pyrimidin-2-ylidene]methyl]phenoxy]acetic acid 0
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