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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:cyclazosin
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Accession:CHEBI:63937 term browser browse the term
Definition:A monocarboxylic acid amide obtained by formal condensation of the carboxy group of furoic acid with the secondary amino group of 6,7-dimethoxy-2-[(4aR,8aS)-octahydroquinoxalin-1-yl]quinazolin-4-amine.
Synonyms:exact_synonym: [(4aR,8aS)-4-(4-amino-6,7-dimethoxyquinazolin-2-yl)octahydroquinoxalin-1(2H)-yl](2-furyl)methanone
 related_synonym: Formula=C23H27N5O4;   InChI=1S/C23H27N5O4/c1-30-19-12-14-15(13-20(19)31-2)25-23(26-21(14)24)28-10-9-27(16-6-3-4-7-17(16)28)22(29)18-8-5-11-32-18/h5,8,11-13,16-17H,3-4,6-7,9-10H2,1-2H3,(H2,24,25,26)/t16-,17+/m0/s1;   InChIKey=XBRXTUGRUXGBPX-DLBZAZTESA-N;   SMILES=[H][C@]12CCCC[C@@]1([H])N(CCN2C(=O)c1ccco1)c1nc(N)c2cc(OC)c(OC)cc2n1;   cis-1-(4-Amino-6,7-dimethoxy-2-quinazolinyl)-4-(2-furanylcarbonyl)decahydroquinoxaline
 xref: CAS:139953-73-4
 xref_mesh: MESH:C080462
 xref: PMID:11036156;   PMID:11294762;   PMID:14634588;   PMID:15598431;   PMID:16213480;   PMID:17276073;   PMID:18037913;   PMID:18702011;   PMID:8666020;   PMID:8917649;   PMID:9851544;   PMID:9871765;   Reaxys:8020551


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  CHEBI ontology 5052
    role 5044
      biological role 5016
        pharmacological role 620
          antagonist 220
            adenosine receptor antagonist 1
              adenosine A2A receptor antagonist 1
                cyclazosin 0
                  cyclazosin hydrochloride 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 5052
    subatomic particle 5043
      composite particle 5043
        hadron 5071
          baryon 5043
            nucleon 5043
              atomic nucleus 5043
                atom 5043
                  main group element atom 5013
                    p-block element atom 5010
                      carbon group element atom 4927
                        carbon atom 4954
                          organic molecular entity 4926
                            heteroorganic entity 4768
                              organochalcogen compound 4730
                                organooxygen compound 4692
                                  carbon oxoacid 368
                                    carboxylic acid 364
                                      carboacyl group 209
                                        univalent carboacyl group 209
                                          carbamoyl group 206
                                            carboxamide 211
                                              monocarboxylic acid amide 97
                                                cyclazosin 0
                                                  cyclazosin hydrochloride 0
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