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CHEBI:90410 - pyronin B(1+)

ChEBI IDCHEBI:90410
ChEBI Namepyronin B(1+)
Stars
DefinitionAn iminium ion that is the cationic component of pyronin B
Last Modified17 November 2015
SubmitterSteve
DownloadsMolfile
FormulaC21H27N2O
Net Charge+1
Average Mass323.460
Monoisotopic Mass323.21179
SMILESCCN(CC)c1ccc2cc3ccc(=[N+](CC)CC)cc-3oc2c1
InChIInChI=1S/C21H27N2O/c1-5-22(6-2)18-11-9-16-13-17-10-12-19(23(7-3)8-4)15-21(17)24-20(16)14-18/h9-15H,5-8H2,1-4H3/q+1
InChIKeyBIOUTGSRJYRPFT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
pyronin B(1+) (CHEBI:90410) is a iminium ion (CHEBI:35286)
Incoming Relation(s)
pyronin B (CHEBI:90405) has part pyronin B(1+) (CHEBI:90410)
pyronin B-FeCl3 complex (CHEBI:90411) has part pyronin B(1+) (CHEBI:90410)
IUPAC Name 
6-(diethylamino)-N,N-diethyl-3H-xanthen-3-iminium
Synonym  Source
pyronin B cationChEBI