PI3-Kinase alpha Inhibitor 2 (CHEBI:187241)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	PI3-Kinase alpha Inhibitor 2

ChEBI ID	CHEBI:187241

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H15N3O2S

Net Charge

Average Mass

313.380

Monoisotopic Mass

313.08850

InChI

InChI=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

InChIKey

XXLAEKOWCYJOKK-UHFFFAOYSA-N

SMILES

S1C=2C(N3CCOCC3)=NC(=NC2C=C1)C4=CC(O)=CC=C4

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study

ChEBI Ontology
Outgoing	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