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CHEBI:65208 - E-3810(1+)

ChEBI IDCHEBI:65208
ChEBI NameE-3810(1+)
Stars
DefinitionAn organic cation obtained by protonation of the primary amino function of 6-({7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl}oxy)-N-methyl-1-naphthamide
Last Modified11 July 2012
SubmitterSteve
DownloadsMolfile
FormulaC26H26N3O4
Net Charge+1
Average Mass444.511
Monoisotopic Mass444.19178
SMILESCNC(=O)c1cccc2cc(Oc3ccnc4cc(OCC5([NH3+])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)/p+1
InChIKeyCUDVHEFYRIWYQD-UHFFFAOYSA-O
ChEBI Ontology
Outgoing Relation(s)
E-3810(1+) (CHEBI:65208) is a ammonium ion derivative (CHEBI:35274)
E-3810(1+) (CHEBI:65208) is a organic cation (CHEBI:25697)
E-3810(1+) (CHEBI:65208) is conjugate acid of E-3810 free base (CHEBI:65209)
Incoming Relation(s)
E-3810 (CHEBI:65138) has part E-3810(1+) (CHEBI:65208)
E-3810 free base (CHEBI:65209) is conjugate base of E-3810(1+) (CHEBI:65208)
Synonyms  Source
E-3810 cationChEBI
1-{[(6-methoxy-4-{[5-(methylcarbamoyl)-2-naphthyl]oxy}quinolin-7-yl)oxy]methyl}cyclopropanaminiumChEBI