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CHEBI:173077 - copanlisib

ChEBI IDCHEBI:173077
ChEBI Namecopanlisib
Stars
DefinitionAn imidazoquinazoline that is 2,3-dihydroimidazo[1,2-c]quinazoline substituted by (2-aminopyrimidine-5-carbonyl)amino, methoxy, and 3-(morpholin-4-yl)propoxy groups at positions 5, 7 and 8, respectively. It is a intravenous pan-class I PI3K inhibitor used for the treatment of relapsed follicular lymphoma in patients who have received at least 2 prior systemic therapies.
Last Modified25 May 2021
SubmitterR. Stephan
DownloadsMolfile
FormulaC23H28N8O4
Net Charge0
Average Mass480.529
Monoisotopic Mass480.22335
SMILESCOc1c(OCCCN2CCOCC2)ccc2c1N=C(NC(=O)c1cnc(N)nc1)N1CCN=C21
InChIInChI=1S/C23H28N8O4/c1-33-19-17(35-10-2-6-30-8-11-34-12-9-30)4-3-16-18(19)28-23(31-7-5-25-20(16)31)29-21(32)15-13-26-22(24)27-14-15/h3-4,13-14H,2,5-12H2,1H3,(H2,24,26,27)(H,28,29,32)
InChIKeyPZBCKZWLPGJMAO-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor  An inhibitor of phosphatidylinositol 3-kinase, EC 2.7.1.137, a family of related enzymes capable of phosphorylating the 3 position hydroxy group of the inositol ring of a phosphatidylinositol.
apoptosis inducer  Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
copanlisib (CHEBI:173077) has role antineoplastic agent (CHEBI:35610)
copanlisib (CHEBI:173077) has role apoptosis inducer (CHEBI:68495)
copanlisib (CHEBI:173077) has role EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor (CHEBI:50914)
copanlisib (CHEBI:173077) is a aminopyrimidine (CHEBI:38338)
copanlisib (CHEBI:173077) is a aromatic ether (CHEBI:35618)
copanlisib (CHEBI:173077) is a diether (CHEBI:46786)
copanlisib (CHEBI:173077) is a imidazoquinazoline (CHEBI:47975)
copanlisib (CHEBI:173077) is a morpholines (CHEBI:38785)
copanlisib (CHEBI:173077) is a pyrimidinecarboxamide (CHEBI:48438)
copanlisib (CHEBI:173077) is a secondary carboxamide (CHEBI:140325)
copanlisib (CHEBI:173077) is a tertiary amino compound (CHEBI:50996)
Incoming Relation(s)
copanlisib dihydrochloride (CHEBI:173081) has part copanlisib (CHEBI:173077)
IUPAC Name 
2-amino-N-{7-methoxy-8-[3-(morpholin-4-yl)propoxy]-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl}pyrimidine-5-carboxamide
INNs  Source
copanlisibWHO MedNet
copanlisibumWHO MedNet
copanlisibWHO MedNet
copanlisibWHO MedNet
Synonyms  Source
BAY 80-6946ChemIDplus
BAY-80-6946DrugBank
BAY80-6946DrugBank
Manual XrefsDatabases
DB12483DrugBank
6E2PDBeChem
CopanlisibWikipedia
D10867KEGG DRUG
25069683ChemSpider
5256DrugCentral
Registry NumbersSources
CAS:1032568-63-0ChemIDplus
Citations