CHEBI:65209 - E-3810 free base

ChEBI IDCHEBI:65209
ChEBI NameE-3810 free base
Stars
DefinitionA naphthalenecarboxamide obtained from formal condensation of the carboxy group of aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl}oxy)-1-naphthoic acid with methylamine.
Last Modified6 March 2014
SubmitterSteve
DownloadsMolfile
FormulaC26H25N3O4
Net Charge0
Average Mass443.503
Monoisotopic Mass443.18451
SMILESCNC(=O)c1cccc2cc(Oc3ccnc4cc(OCC5(N)CC5)c(OC)cc34)ccc12
InChIInChI=1S/C26H25N3O4/c1-28-25(30)19-5-3-4-16-12-17(6-7-18(16)19)33-22-8-11-29-21-14-24(23(31-2)13-20(21)22)32-15-26(27)9-10-26/h3-8,11-14H,9-10,15,27H2,1-2H3,(H,28,30)
InChIKeyCUDVHEFYRIWYQD-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
fibroblast growth factor receptor antagonist  An antagonist at the fibroblast growth factor receptor.
vascular endothelial growth factor receptor antagonist  An antagonist at the vascular endothelial growth factor receptor.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
E-3810 free base (CHEBI:65209) has role antineoplastic agent (CHEBI:35610)
E-3810 free base (CHEBI:65209) has role fibroblast growth factor receptor antagonist (CHEBI:63457)
E-3810 free base (CHEBI:65209) has role vascular endothelial growth factor receptor antagonist (CHEBI:65207)
E-3810 free base (CHEBI:65209) is a aromatic ether (CHEBI:35618)
E-3810 free base (CHEBI:65209) is a cyclopropanes (CHEBI:51454)
E-3810 free base (CHEBI:65209) is a naphthalenecarboxamide (CHEBI:48739)
E-3810 free base (CHEBI:65209) is a primary amino compound (CHEBI:50994)
E-3810 free base (CHEBI:65209) is a quinolines (CHEBI:26513)
E-3810 free base (CHEBI:65209) is conjugate base of E-3810(1+) (CHEBI:65208)
Incoming Relation(s)
E-3810(1+) (CHEBI:65208) is conjugate acid of E-3810 free base (CHEBI:65209)
IUPAC Name 
6-({7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl}oxy)-N-methyl-1-naphthamide
Synonym  Source
E-3810 amineChEBI
Registry NumbersSources
Reaxys:18478470Reaxys