EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:121568 - 1,4-dioxa-8-azaspiro[4.5]decan-8-yl-(5,7-diphenyl-2-pyrazolo[1,5-a]pyrimidinyl)methanone

ChEBI IDCHEBI:121568
ChEBI Name1,4-dioxa-8-azaspiro[4.5]decan-8-yl-(5,7-diphenyl-2-pyrazolo[1,5-a]pyrimidinyl)methanone
Stars
DownloadsMolfile
FormulaC26H24N4O3
Net Charge0
Average Mass440.503
Monoisotopic Mass440.18484
SMILESO=C(c1cc2nc(-c3ccccc3)cc(-c3ccccc3)n2n1)N1CCC2(CC1)OCCO2
InChIInChI=1S/C26H24N4O3/c31-25(29-13-11-26(12-14-29)32-15-16-33-26)22-18-24-27-21(19-7-3-1-4-8-19)17-23(30(24)28-22)20-9-5-2-6-10-20/h1-10,17-18H,11-16H2
InChIKeyKLARLECYBZJKAD-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1,4-dioxa-8-azaspiro[4.5]decan-8-yl-(5,7-diphenyl-2-pyrazolo[1,5-a]pyrimidinyl)methanone (CHEBI:121568) is a pyrimidines (CHEBI:39447)
Manual XrefsDatabases
LSM-33011LINCS