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CHEBI:82368 - Ponceau 3R

ChEBI IDCHEBI:82368
ChEBI NamePonceau 3R
Stars
DownloadsMolfile
FormulaC19H16N2O7S2.HNa.Na
Net Charge-1
Average Mass495.466
Monoisotopic Mass495.02781
SMILESCc1cc(C)c(/N=N/c2c(O)c(S(=O)(=O)[O-])cc3cc(S(=O)(=O)[O-])ccc23)cc1C.[Na+].[NaH]
InChIInChI=1S/C19H18N2O7S2.2Na.H/c1-10-6-12(3)16(7-11(10)2)20-21-18-15-5-4-14(29(23,24)25)8-13(15)9-17(19(18)22)30(26,27)28;;;/h4-9,22H,1-3H3,(H,23,24,25)(H,26,27,28);;;/q;;+1;/p-2/b21-20+;;;
InChIKeyZACKGRTYZWEINS-BFUOAJNWSA-L
ChEBI Ontology
Outgoing Relation(s)
Ponceau 3R (CHEBI:82368) is a organic molecular entity (CHEBI:50860)
Manual XrefsDatabases
C19293KEGG COMPOUND
Registry NumbersSources
CAS:3564-09-8KEGG COMPOUND