CHEBI:172664 - 5-Amino-4-hydroxy-3-(phenylazo)-2,7-naphthalenedisulfonic acid

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ChEBI Name 5-Amino-4-hydroxy-3-(phenylazo)-2,7-naphthalenedisulfonic acid
ChEBI ID CHEBI:172664
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H13N3O7S2
Net Charge 0
Average Mass 423.410
Monoisotopic Mass 423.01949
InChI InChI=1S/C16H13N3O7S2/c17-12-8-11(27(21,22)23)6-9-7-13(28(24,25)26)15(16(20)14(9)12)19-18-10-4-2-1-3-5-10/h1-8,20H,17H2,(H,21,22,23)(H,24,25,26)/b19-18+
InChIKey UDCKXEFJOHLCKM-VHEBQXMUSA-N
SMILES S(O)(=O)(=O)C1=CC=2C(=C(N)C=C(S(O)(=O)=O)C2)C(O)=C1/N=N/C3=CC=CC=C3
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
ChEBI Ontology
Outgoing 5-Amino-4-hydroxy-3-(phenylazo)-2,7-naphthalenedisulfonic acid (CHEBI:172664) is a naphthalenesulfonic acid (CHEBI:36336)
IUPAC Name
5-amino-4-hydroxy-3-phenyldiazenylnaphthalene-2,7-disulonic acid
Manual Xref Database
22902833 ChemSpider
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Registry Number Type Source
2203-16-9 CAS Registry Number ChemIDplus