CHEBI:187241 - PI3-Kinase alpha Inhibitor 2

ChEBI IDCHEBI:187241
ChEBI NamePI3-Kinase alpha Inhibitor 2
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H15N3O2S
Net Charge0
Average Mass313.382
Monoisotopic Mass313.08850
SMILESOc1cccc(-c2nc(N3CCOCC3)c3sccc3n2)c1
InChIInChI=1S/C16H15N3O2S/c20-12-3-1-2-11(10-12)15-17-13-4-9-22-14(13)16(18-15)19-5-7-21-8-6-19/h1-4,9-10,20H,5-8H2
InChIKeyXXLAEKOWCYJOKK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
PI3-Kinase alpha Inhibitor 2 (CHEBI:187241) is a organic heterobicyclic compound (CHEBI:27171)
PI3-Kinase alpha Inhibitor 2 (CHEBI:187241) is a organonitrogen heterocyclic compound (CHEBI:38101)
PI3-Kinase alpha Inhibitor 2 (CHEBI:187241) is a organosulfur heterocyclic compound (CHEBI:38106)
IUPAC Name 
3-(4-morpholin-4-ylthieno[3,2-d]pyrimidin-2-yl)phenol
Manual XrefsDatabases
AJZPDBeChem
8077026ChemSpider