CHEBI:63937 - cyclazosin

ChEBI IDCHEBI:63937
ChEBI Namecyclazosin
Stars
DefinitionA 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.
Last Modified6 March 2014
SubmitterSteve
DownloadsMolfile
FormulaC23H27N5O4
Net Charge0
Average Mass437.500
Monoisotopic Mass437.20630
SMILES[H][C@@]12CCCC[C@]1([H])N(C(=O)c1ccco1)CCN2c1nc(N)c2cc(OC)c(OC)cc2n1
InChIInChI=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
InChIKeyXBRXTUGRUXGBPX-DLBZAZTESA-N
Roles Classification
Biological Role:
adenosine A2A receptor antagonist  An antagonist at the A2A receptor.
ChEBI Ontology
Outgoing Relation(s)
cyclazosin (CHEBI:63937) has role adenosine A2A receptor antagonist (CHEBI:53121)
cyclazosin (CHEBI:63937) is a aromatic amide (CHEBI:62733)
cyclazosin (CHEBI:63937) is a aromatic ether (CHEBI:35618)
cyclazosin (CHEBI:63937) is a furans (CHEBI:24129)
cyclazosin (CHEBI:63937) is a monocarboxylic acid amide (CHEBI:29347)
cyclazosin (CHEBI:63937) is a quinazolines (CHEBI:38530)
cyclazosin (CHEBI:63937) is a quinoxaline derivative (CHEBI:38771)
Incoming Relation(s)
cyclazosin hydrochloride (CHEBI:63935) has part cyclazosin (CHEBI:63937)
IUPAC Name 
[(4aR,8aS)-4-(4-amino-6,7-dimethoxyquinazolin-2-yl)octahydroquinoxalin-1(2H)-yl](2-furyl)methanone
Synonym  Source
cis-1-(4-Amino-6,7-dimethoxy-2-quinazolinyl)-4-(2-furanylcarbonyl)decahydroquinoxalineChemIDplus
Registry NumbersSources
Reaxys:8020551Reaxys
CAS:139953-73-4ChemIDplus
Citations