EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:52294 - thionine acetate

ChEBI IDCHEBI:52294
ChEBI Namethionine acetate
Stars
Last Modified17 October 2009
SubmitterInma Spiteri
DownloadsMolfile
FormulaC12H10N3S.C2H3O2
Net Charge0
Average Mass287.344
Monoisotopic Mass287.07285
SMILESCC(=O)[O-].Nc1ccc2nc3ccc(N)cc3[s+]c2c1
InChIInChI=1S/C12H10N3S.C2H4O2/c13-7-1-3-9-11(5-7)16-12-6-8(14)2-4-10(12)15-9;1-2(3)4/h1-6H,13-14H2;1H3,(H,3,4)/q+1;/p-1
InChIKeyOWXBIRAFHWASMS-UHFFFAOYSA-M
Roles Classification
Application:
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
thionine acetate (CHEBI:52294) has part thionine cation (CHEBI:52926)
thionine acetate (CHEBI:52294) has role fluorochrome (CHEBI:51217)
thionine acetate (CHEBI:52294) is a organic salt (CHEBI:24868)
IUPAC Name 
3,7-diaminophenothiazin-5-ium acetate
Synonyms  Source
thionin acetateChEBI
ThioninacetatChEBI
Registry NumbersSources
Beilstein:4345073Beilstein