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CHEBI:184549 - 3-[(e)-2-(2,4-Dimethyl-5-sulfophenyl)diazen-1-yl]-4-hydroxynaphthalene-1-sulfonic acid

Default Structure
ChEBI IDCHEBI:184549
ChEBI Name3-[(e)-2-(2,4-Dimethyl-5-sulfophenyl)diazen-1-yl]-4-hydroxynaphthalene-1-sulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H16N2O7S2
Net Charge0
Average Mass436.467
Monoisotopic Mass436.03989
SMILESCc1cc(C)c(S(=O)(=O)O)cc1/N=N/c1cc(S(=O)(=O)O)c2ccccc2c1O
InChIInChI=1S/C18H16N2O7S2/c1-10-7-11(2)16(28(22,23)24)8-14(10)19-20-15-9-17(29(25,26)27)12-5-3-4-6-13(12)18(15)21/h3-9,21H,1-2H3,(H,22,23,24)(H,25,26,27)/b20-19+
InChIKeyDZCOAQKTFAIFRV-FMQUCBEESA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913) spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein [LBO:0000132]
ChEBI Ontology
Outgoing Relation(s)
3-[(e)-2-(2,4-Dimethyl-5-sulfophenyl)diazen-1-yl]-4-hydroxynaphthalene-1-sulfonic acid (CHEBI:184549) is a naphthalenesulfonic acid (CHEBI:36336)
IUPAC Name 
3-[(2,4-dimethyl-5-sulophenyl)diazenyl]-4-hydroxynaphthalene-1-sulonic acid
Manual XrefsDatabases
23349836ChemSpider