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ONTOLOGY REPORT - ANNOTATIONS


Term:N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2-pyrazinecarboxamide
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Accession:CHEBI:113685 term browser browse the term
Definition:A pyrazine that has formula C21H27N5O4.
Synonyms:related_synonym: Formula=C21H27N5O4;   InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14-,18+/m1/s1;   InChIKey=TWHSADQACYCNBZ-LBTNJELSSA-N;   SMILES=C[C@@H]1CN(C(=O)C2=C(C(=CC=C2)NC(=O)C3=NC=CN=C3)O[C@H]1CNC)[C@H](C)CO
 xref: LINCS:LSM-25117


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Term Annotations click to browse term
  CHEBI ontology 21038
    chemical entity 21036
      atom 21032
        nonmetal atom 20848
          nitrogen atom 18720
            nitrogen molecular entity 18720
              organonitrogen compound 18657
                carboxamide 17157
                  secondary carboxamide 209
                    N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2-pyrazinecarboxamide 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 21038
    subatomic particle 21032
      composite particle 21032
        hadron 21032
          baryon 21032
            nucleon 21032
              atomic nucleus 21032
                atom 21032
                  main group element atom 20874
                    p-block element atom 20874
                      carbon group element atom 20609
                        carbon atom 20586
                          organic molecular entity 20586
                            organic group 19181
                              organic divalent group 19171
                                organodiyl group 19171
                                  carbonyl group 19143
                                    carbonyl compound 19143
                                      carboxylic acid 18821
                                        carboacyl group 17455
                                          univalent carboacyl group 17455
                                            carbamoyl group 17157
                                              carboxamide 17157
                                                secondary carboxamide 209
                                                  N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2-pyrazinecarboxamide 0
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