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CHEBI:82414 - Carmoisine

Default Structure
ChEBI IDCHEBI:82414
ChEBI NameCarmoisine
Stars
DownloadsMolfile
FormulaC20H12N2O7S2.2Na
Net Charge0
Average Mass502.437
Monoisotopic Mass501.98813
SMILESO=S(=O)([O-])c1ccc(/N=N/c2cc(S(=O)(=O)[O-])c3ccccc3c2O)c2ccccc12.[Na+].[Na+]
InChIInChI=1S/C20H14N2O7S2.2Na/c23-20-15-8-4-3-7-14(15)19(31(27,28)29)11-17(20)22-21-16-9-10-18(30(24,25)26)13-6-2-1-5-12(13)16;;/h1-11,23H,(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2/b22-21+;;
InChIKeyYSVBPNGJESBVRM-ZPZFBZIMSA-L
ChEBI Ontology
Outgoing Relation(s)
Carmoisine (CHEBI:82414) is a organic molecular entity (CHEBI:50860)
Synonyms  Source
AzorubinKEGG COMPOUND
C.I. Acid Red 14KEGG COMPOUND
Manual XrefsDatabases
C19358KEGG COMPOUND
Registry NumbersSources
CAS:3567-69-9KEGG COMPOUND