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CHEBI:82425 - CI Acid Orange 3

Default Structure
ChEBI IDCHEBI:82425
ChEBI NameCI Acid Orange 3
Stars
DownloadsMolfile
FormulaC18H13N4O7S.Na
Net Charge0
Average Mass452.380
Monoisotopic Mass452.04026
SMILESO=[N+]([O-])c1ccc(Nc2ccc(Nc3ccccc3)c(S(=O)(=O)[O-])c2)c([N+](=O)[O-])c1.[Na+]
InChIInChI=1S/C18H14N4O7S.Na/c23-21(24)14-7-9-15(17(11-14)22(25)26)20-13-6-8-16(18(10-13)30(27,28)29)19-12-4-2-1-3-5-12;/h1-11,19-20H,(H,27,28,29);/q;+1/p-1
InChIKeyKKBFCPLWFWQNFB-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
CI Acid Orange 3 (CHEBI:82425) is a organic molecular entity (CHEBI:50860)
Synonyms  Source
2-Anilino-5-(2,4-dinitroanilino)-benzenesulfonic acidKEGG COMPOUND
C.I. Acid Orange 3KEGG COMPOUND
Manual XrefsDatabases
C19370KEGG COMPOUND
Registry NumbersSources
CAS:6373-74-6KEGG COMPOUND