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CHEBI:87188 - Biebrich scarlet(2−)

ChEBI IDCHEBI:87188
ChEBI NameBiebrich scarlet(2−)
Stars
ASCII NameBiebrich scarlet(2-)
DefinitionAn organosulfonate oxoanion obtained by deprotonation of the sulfo groups of Biebrich scarlet.
Last Modified29 July 2015
SubmitterSteve
DownloadsMolfile
FormulaC22H14N4O7S2
Net Charge-2
Average Mass510.509
Monoisotopic Mass510.03149
SMILESO=S(=O)([O-])c1ccc(N=Nc2ccc(N=Nc3c(O)ccc4ccccc34)c(S(=O)(=O)[O-])c2)cc1
InChIInChI=1S/C22H16N4O7S2/c27-20-12-5-14-3-1-2-4-18(14)22(20)26-25-19-11-8-16(13-21(19)35(31,32)33)24-23-15-6-9-17(10-7-15)34(28,29)30/h1-13,27H,(H,28,29,30)(H,31,32,33)/p-2
InChIKeyBYABGQJPCPYPSZ-UHFFFAOYSA-L
ChEBI Ontology
Outgoing Relation(s)
Biebrich scarlet(2−) (CHEBI:87188) is a organosulfonate oxoanion (CHEBI:33554)
Biebrich scarlet(2−) (CHEBI:87188) is conjugate base of Biebrich scarlet (acid form) (CHEBI:87187)
Incoming Relation(s)
Biebrich scarlet (CHEBI:87186) has part Biebrich scarlet(2−) (CHEBI:87188)
Biebrich scarlet (acid form) (CHEBI:87187) is conjugate acid of Biebrich scarlet(2−) (CHEBI:87188)
IUPAC Name 
2-[(2-hydroxynaphthalen-1-yl)diazenyl]-5-[(4-sulfonatophenyl)diazenyl]benzene-1-sulfonate
Synonyms  Source
Biebrich scarlet anionChEBI
Biebrich scarlet dianionChEBI