CHEBI:90319 - Ponceau S

ChEBI IDCHEBI:90319
ChEBI NamePonceau S
Stars
DefinitionAn organic sodium salt that is the tetrasodium salt of 3-hydroxy-4-({2-sulfo-4-[(4-sulfophenyl)diazenyl]phenyl}diazenyl)naphthalene-2,7-disulfonic acid.
Last Modified12 November 2015
SubmitterSteve
DownloadsMolfile
FormulaC22H12N4O13S4.4Na
Net Charge0
Average Mass760.581
Monoisotopic Mass759.88745
SMILESO=S(=O)([O-])c1ccc(N=Nc2ccc(N=Nc3c(O)c(S(=O)(=O)[O-])cc4cc(S(=O)(=O)[O-])ccc34)c(S(=O)(=O)[O-])c2)cc1.[Na+].[Na+].[Na+].[Na+]
InChIInChI=1S/C22H16N4O13S4.4Na/c27-22-20(43(37,38)39)10-12-9-16(41(31,32)33)6-7-17(12)21(22)26-25-18-8-3-14(11-19(18)42(34,35)36)24-23-13-1-4-15(5-2-13)40(28,29)30;;;;/h1-11,27H,(H,28,29,30)(H,31,32,33)(H,34,35,36)(H,37,38,39);;;;/q;4*+1/p-4
InChIKeyKQHKSGRIBYJYFX-UHFFFAOYSA-J
Wikipedia
Roles Classification
Applications:
histological dye  A dye used in microscopic or electron microscopic examination of cells and tissues to give contrast and to highlight particular features of interest, such as nuclei and cytoplasm.
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
Ponceau S (CHEBI:90319) has part Ponceau S(4−) (CHEBI:90323)
Ponceau S (CHEBI:90319) has role fluorochrome (CHEBI:51217)
Ponceau S (CHEBI:90319) has role histological dye (CHEBI:77178)
Ponceau S (CHEBI:90319) is a organic sodium salt (CHEBI:38700)
Ponceau S (CHEBI:90319) is a organosulfonate salt (CHEBI:64382)
IUPAC Name 
tetrasodium 3-hydroxy-4-({2-sulfonato-4-[(4-sulfonatophenyl)diazenyl]phenyl}diazenyl)naphthalene-2,7-disulfonate
Synonyms  Source
C.I. 27195ChEBI
Tetrasodium 3-hydroxy-4-(2-sulphonato-4-(4-sulphonatophenylazo)phenylazo)naphthalene-2,7-disulphonateChemIDplus
2-Hydroxy-1-((4((4-sulfophenyl)azo)-2-sulfophenyl)azo)naphthalene-3,6-disulfonic acid, tetrasodium saltChemIDplus
C.I. Acid Red 112, tetrasodium saltChemIDplus
C.I. Acid Red 112ChemIDplus
Ponceau S ExtraChemIDplus
Manual XrefsDatabases
Ponceau_SWikipedia
Registry NumbersSources
Reaxys:6265648Reaxys
CAS:6226-79-5ChemIDplus
Citations