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CHEBI:58871 - 3,3'-biflaviolin 2,2'-diolate

ChEBI IDCHEBI:58871
ChEBI Name3,3'-biflaviolin 2,2'-diolate
Stars
DefinitionDianion of 3,3'-biflaviolin arising from selective deprotonation of the OH groups at the 2- and 2'-positions.
Last Modified11 June 2014
DownloadsMolfile
FormulaC20H8O10
Net Charge-2
Average Mass408.274
Monoisotopic Mass408.01284
SMILESO=C1C([O-])=C(C2=C([O-])C(=O)c3cc(O)cc(O)c3C2=O)C(=O)c2c(O)cc(O)cc21
InChIInChI=1S/C20H10O10/c21-5-1-7-11(9(23)3-5)17(27)13(19(29)15(7)25)14-18(28)12-8(16(26)20(14)30)2-6(22)4-10(12)24/h1-4,21-24,29-30H/p-2
InChIKeyNOKUEYSCIIGRDQ-UHFFFAOYSA-L
ChEBI Ontology
Outgoing Relation(s)
3,3'-biflaviolin 2,2'-diolate (CHEBI:58871) is a organic anion (CHEBI:25696)
3,3'-biflaviolin 2,2'-diolate (CHEBI:58871) is conjugate acid of 3,3'-biflaviolin(3−) (CHEBI:77877)
3,3'-biflaviolin 2,2'-diolate (CHEBI:58871) is conjugate base of 3,3'-biflaviolin (CHEBI:51836)
Incoming Relation(s)
3,3'-biflaviolin (CHEBI:51836) is conjugate acid of 3,3'-biflaviolin 2,2'-diolate (CHEBI:58871)
3,3'-biflaviolin(3−) (CHEBI:77877) is conjugate base of 3,3'-biflaviolin 2,2'-diolate (CHEBI:58871)
IUPAC Name 
6,6',8,8'-tetrahydroxy-1,1',4,4'-tetraoxo-1,1',4,4'-tetrahydro-2,2'-binaphthalene-3,3'-diolate
Synonym  Source
3-(6,8-dihydroxy-3-oxido-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-5,7-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-olateChEBI