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CHEBI:184400 - 2-{4-[(e)-2-(1-hydroxy-4-sulfonaphthalen-2-yl)diazen-1-yl]phenyl}-6-methyl-1,3-benzothiazole-7-sulfonic acid

ChEBI IDCHEBI:184400
ChEBI Name2-{4-[(e)-2-(1-hydroxy-4-sulfonaphthalen-2-yl)diazen-1-yl]phenyl}-6-methyl-1,3-benzothiazole-7-sulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H17N3O7S3
Net Charge0
Average Mass555.615
Monoisotopic Mass555.02286
SMILESCc1ccc2nc(-c3ccc(/N=N/c4cc(S(=O)(=O)O)c5ccccc5c4O)cc3)sc2c1S(=O)(=O)O
InChIInChI=1S/C24H17N3O7S3/c1-13-6-11-18-22(23(13)37(32,33)34)35-24(25-18)14-7-9-15(10-8-14)26-27-19-12-20(36(29,30)31)16-4-2-3-5-17(16)21(19)28/h2-12,28H,1H3,(H,29,30,31)(H,32,33,34)/b27-26+
InChIKeyNAXWWTPJXAIEJE-CYYJNZCTSA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913) spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein [LBO:0000132]
ChEBI Ontology
Outgoing Relation(s)
2-{4-[(e)-2-(1-hydroxy-4-sulfonaphthalen-2-yl)diazen-1-yl]phenyl}-6-methyl-1,3-benzothiazole-7-sulfonic acid (CHEBI:184400) is a naphthalenesulfonic acid (CHEBI:36336)
IUPAC Name 
2-[4-[(1-hydroxy-4-sulonaphthalen-2-yl)diazenyl]phenyl]-6-methyl-1,3-benzothiazole-7-sulonic acid
Manual XrefsDatabases
23350494ChemSpider