CHEBI:88289 - ethyl green(1+)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name ethyl green(1+)
ChEBI ID CHEBI:88289
Definition An iminium ion that forms the cationic portion of the histological dye 'ethyl green'.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C27H35N3
Net Charge +2
Average Mass 401.588
Monoisotopic Mass 401.28200
InChI InChI=1S/C27H35N3/c1-8-30(6,7)26-19-13-23(14-20-26)27(21-9-15-24(16-10-21)28(2)3)22-11-17-25(18-12-22)29(4)5/h9-20H,8H2,1-7H3/q+2
InChIKey ZRJYQNPSWSGCMS-UHFFFAOYSA-N
SMILES C(C=1C=CC([N+](CC)(C)C)=CC1)(C2=CC=C(N(C)C)C=C2)=C3C=CC(=[N+](C)C)C=C3
ChEBI Ontology
Outgoing ethyl green(1+) (CHEBI:88289) is a iminium ion (CHEBI:35286)
ethyl green(1+) (CHEBI:88289) is a quaternary ammonium ion (CHEBI:35267)
Incoming ethyl green (CHEBI:88288) has part ethyl green(1+) (CHEBI:88289)
IUPAC Name
[4-([4-(dimethylamino)phenyl]{4-[ethyl(dimethyl)azaniumyl]phenyl}methylidene)cyclohexa-2,5-dien-1-ylidene](dimethyl)ammonium
Synonym Source
ethyl green cation ChEBI
Last Modified
20 October 2015