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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:3-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-N-(3,4-dihydro-2H-pyrrol-5-yl)benzamide
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Accession:CHEBI:95009 term browser browse the term
Definition:A pyrazole that has formula C19H21N7O.
Synonyms:related_synonym: Formula=C19H21N7O;   InChI=1S/C19H21N7O/c1-11(2)26-18-15(17(20)22-10-23-18)16(25-26)12-5-3-6-13(9-12)19(27)24-14-7-4-8-21-14/h3,5-6,9-11H,4,7-8H2,1-2H3,(H2,20,22,23)(H,21,24,27);   InChIKey=RWRBSEISHUTNQL-UHFFFAOYSA-N;   SMILES=CC(C)N1C2=C(C(=N1)C3=CC(=CC=C3)C(=O)NC4=NCCC4)C(=NC=N2)N
 xref: LINCS:LSM-6238


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  CHEBI ontology 0
    chemical entity 0
      molecular entity 0
        polyatomic entity 0
          molecule 0
            cyclic compound 0
              ring assembly 0
                3-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-N-(3,4-dihydro-2H-pyrrol-5-yl)benzamide 0
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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
                                  heteroarene 0
                                    monocyclic heteroarene 0
                                      azole 0
                                        diazole 0
                                          pyrazoles 0
                                            3-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-N-(3,4-dihydro-2H-pyrrol-5-yl)benzamide 0
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