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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:(3R)-2-acetyl-N-ethyl-3-(2-hydroxyethyl)-4-[3-(5-pyrimidinyl)phenyl]-1,3-dihydropyrrolo[3,4-c]pyridine-6-carboxamide
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Accession:CHEBI:130565 term browser browse the term
Definition:A pyrimidine that has formula C24H25N5O3.
Synonyms:related_synonym: Formula=C24H25N5O3;   InChI=1S/C24H25N5O3/c1-3-27-24(32)20-10-18-13-29(15(2)31)21(7-8-30)22(18)23(28-20)17-6-4-5-16(9-17)19-11-25-14-26-12-19/h4-6,9-12,14,21,30H,3,7-8,13H2,1-2H3,(H,27,32)/t21-/m1/s1;   InChIKey=KYUSNWFIEQEQHP-OAQYLSRUSA-N;   SMILES=CCNC(=O)C1=NC(=C2[C@H](N(CC2=C1)C(=O)C)CCO)C3=CC=CC(=C3)C4=CN=CN=C4
 xref: LINCS:LSM-42114

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  CHEBI ontology 0
    chemical entity 0
      atom 0
        nonmetal atom 0
          nitrogen atom 0
            nitrogen molecular entity 0
              organonitrogen compound 0
                organonitrogen heterocyclic compound 0
                  diazines 0
                    pyrimidines 0
                      (3R)-2-acetyl-N-ethyl-3-(2-hydroxyethyl)-4-[3-(5-pyrimidinyl)phenyl]-1,3-dihydropyrrolo[3,4-c]pyridine-6-carboxamide 0
Path 2
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            organic molecule 0
                              organic cyclic compound 0
                                organic heterocyclic compound 0
                                  organic heteromonocyclic compound 0
                                    diazines 0
                                      pyrimidines 0
                                        (3R)-2-acetyl-N-ethyl-3-(2-hydroxyethyl)-4-[3-(5-pyrimidinyl)phenyl]-1,3-dihydropyrrolo[3,4-c]pyridine-6-carboxamide 0
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