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CHEBI:88024 - 4-amino-5-hydroxy-3-[(4-nitrophenyl)diazenyl]-6-[(4-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate

ChEBI IDCHEBI:88024
ChEBI Name4-amino-5-hydroxy-3-[(4-nitrophenyl)diazenyl]-6-[(4-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate
Stars
DefinitionAn organosulfonate oxoanion obtained by deprotonation of the sulfonic acid groups of naphthalene blue black CS (acid form).
Last Modified24 September 2015
SubmitterSteve
DownloadsMolfile
FormulaC22H13N6O12S3
Net Charge-3
Average Mass649.577
Monoisotopic Mass648.97700
SMILESNc1c(/N=N/c2ccc([N+](=O)[O-])cc2)c(S(=O)(=O)[O-])cc2cc(S(=O)(=O)[O-])c(/N=N/c3ccc(S(=O)(=O)[O-])cc3)c(O)c12
InChIInChI=1S/C22H16N6O12S3/c23-19-18-11(9-16(42(35,36)37)20(19)26-24-12-1-5-14(6-2-12)28(30)31)10-17(43(38,39)40)21(22(18)29)27-25-13-3-7-15(8-4-13)41(32,33)34/h1-10,29H,23H2,(H,32,33,34)(H,35,36,37)(H,38,39,40)/p-3/b26-24+,27-25+
InChIKeyTWXYZBYSOWJDEU-OWUYFMIJSA-K
ChEBI Ontology
Outgoing Relation(s)
4-amino-5-hydroxy-3-[(4-nitrophenyl)diazenyl]-6-[(4-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate (CHEBI:88024) is a organosulfonate oxoanion (CHEBI:33554)
4-amino-5-hydroxy-3-[(4-nitrophenyl)diazenyl]-6-[(4-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate (CHEBI:88024) is conjugate base of naphthalene blue black CS (acid form) (CHEBI:88019)
Incoming Relation(s)
naphthalene blue black CS (CHEBI:88016) has part 4-amino-5-hydroxy-3-[(4-nitrophenyl)diazenyl]-6-[(4-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate (CHEBI:88024)
naphthalene blue black CS (acid form) (CHEBI:88019) is conjugate acid of 4-amino-5-hydroxy-3-[(4-nitrophenyl)diazenyl]-6-[(4-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate (CHEBI:88024)
IUPAC Name 
4-amino-5-hydroxy-3-[(4-nitrophenyl)diazenyl]-6-[(4-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate