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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:AZD-1152
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Accession:CHEBI:91367 term browser browse the term
Definition:A member of the of quinazolines that is 4-aminoquinazolin-7-ol in which the amino group at position 4 has been substituted by a 5-[2-(3-fluoroanilino)-2-oxoethyl]-1H-pyrazol-3-yl group, while the hydroxy group at position 7 has been converted into the corresponding 3-[ethyl(2-hydroxyethyl)aminopropyl ether.
Synonyms:exact_synonym: 2-{3-[(7-{3-[ethyl(2-hydroxyethyl)amino]propoxy}quinazolin-4-yl)amino]-1H-pyrazol-5-yl}-N-(3-fluorophenyl)acetamide
 related_synonym: AZD-2811;   AZD1152;   Formula=C26H30FN7O3;   InChI=1S/C26H30FN7O3/c1-2-34(10-11-35)9-4-12-37-21-7-8-22-23(16-21)28-17-29-26(22)31-24-14-20(32-33-24)15-25(36)30-19-6-3-5-18(27)13-19/h3,5-8,13-14,16-17,35H,2,4,9-12,15H2,1H3,(H,30,36)(H2,28,29,31,32,33);   InChIKey=QYZOGCMHVIGURT-UHFFFAOYSA-N;   SMILES=CCN(CCO)CCCOC1=CC2=C(C=C1)C(NC1=NNC(CC(=O)NC3=CC(F)=CC=C3)=C1)=NC=N2
 xref: CAS:722544-51-6;   LINCS:LSM-1067;   PMID:18367484;   PMID:20159992;   PMID:25277659;   PMID:25752998;   PMID:28639950;   PMID:29197031;   PMID:30051358



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  CHEBI ontology 20069
    role 20021
      application 19757
        pharmaceutical 19631
          drug 19631
            antineoplastic agent 17643
              AZD-1152 0
                AZT-1152 0
Path 2
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  CHEBI ontology 20069
    subatomic particle 20068
      composite particle 20068
        hadron 20068
          baryon 20068
            nucleon 20068
              atomic nucleus 20068
                atom 20068
                  main group element atom 19969
                    main group molecular entity 19969
                      s-block molecular entity 19761
                        hydrogen molecular entity 19753
                          hydrides 19115
                            inorganic hydride 17872
                              pnictogen hydride 17855
                                nitrogen hydride 17741
                                  azane 17489
                                    ammonia 17488
                                      organic amino compound 17488
                                        amine 7924
                                          primary amine 5869
                                            primary arylamine 3141
                                              aniline 2979
                                                anilide 500
                                                  AZD-1152 0
                                                    AZT-1152 0
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