CHEBI:139570 - 8-formyl-8-demethylriboflavin 5'-phosphate(3−)

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ChEBI Name 8-formyl-8-demethylriboflavin 5'-phosphate(3−)
ChEBI ID CHEBI:139570
ChEBI ASCII Name 8-formyl-8-demethylriboflavin 5'-phosphate(3-)
Definition An organophosphate oxoanion obtained by deprotonation of the phosphate and 3-imido groups of 8-formyl-8-demethylriboflavin 5'-phosphate. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C17H16N4O10P
Net Charge -3
Average Mass 467.304
Monoisotopic Mass 467.06205
InChI InChI=1S/C17H19N4O10P/c1-7-2-9-10(3-8(7)5-22)21(15-13(18-9)16(26)20-17(27)19-15)4-11(23)14(25)12(24)6-31-32(28,29)30/h2-3,5,11-12,14,23-25H,4,6H2,1H3,(H3,20,26,27,28,29,30)/p-3/t11-,12+,14-/m0/s1
InChIKey TZAPMZFMEMVUSE-SCRDCRAPSA-K
SMILES C(N1C=2C(=NC3=C1C=C(C(=C3)C)C(=O)[H])C([N-]C(N2)=O)=O)[C@H](O)[C@H](O)[C@H](O)COP([O-])(=O)[O-]
ChEBI Ontology
Outgoing 8-formyl-8-demethylriboflavin 5'-phosphate(3−) (CHEBI:139570) is a organophosphate oxoanion (CHEBI:58945)
8-formyl-8-demethylriboflavin 5'-phosphate(3−) (CHEBI:139570) is conjugate base of 8-formyl-8-demethylriboflavin 5'-phosphate (CHEBI:140156)
Incoming 8-formyl-8-demethylriboflavin 5'-phosphate (CHEBI:140156) is conjugate acid of 8-formyl-8-demethylriboflavin 5'-phosphate(3−) (CHEBI:139570)
IUPAC Name
1-deoxy-1-(8-formyl-7-methyl-2,4-dioxo-2H-benzo[g]pteridin-3-id-10(4H)-yl)-5-O-phosphonato-D-ribitol
Synonyms Sources
8-demethyl-8-formylriboflavin 5'-phosphate UniProt
8-oxoriboflavin 5'-phosphate ChEBI
Manual Xref Database
CPD-19838 MetaCyc
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Last Modified
14 February 2018