CHEBI:59904 - 7,8-didemethyl-8-hydroxy-5-deazariboflavin(1−)

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ChEBI Name 7,8-didemethyl-8-hydroxy-5-deazariboflavin(1−)
ChEBI ID CHEBI:59904
ChEBI ASCII Name 7,8-didemethyl-8-hydroxy-5-deazariboflavin(1-)
Definition Conjugate base of 7,8-didemethyl-8-hydroxy-5-deazariboflavin arising from deprotonation at the 3-position of the pyrimidoquinoline ring system; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anne Morgat
Supplier Information
Download Molfile XML SDF
Formula C16H16N3O7
Net Charge -1
Average Mass 362.31410
Monoisotopic Mass 362.09937
InChI InChI=1S/C16H17N3O7/c20-6-12(23)13(24)11(22)5-19-10-4-8(21)2-1-7(10)3-9-14(19)17-16(26)18-15(9)25/h1-4,11-13,20,22-24H,5-6H2,(H2,17,18,21,25,26)/p-1/t11-,12+,13-/m0/s1
InChIKey YUTUUCYDXGWRNU-XQQFMLRXSA-M
SMILES OC[C@@H](O)[C@@H](O)[C@@H](O)Cn1c2cc(O)ccc2cc2c1nc(=O)[n-]c2=O
ChEBI Ontology
Outgoing 7,8-didemethyl-8-hydroxy-5-deazariboflavin(1−) (CHEBI:59904) is a organic anion (CHEBI:25696)
7,8-didemethyl-8-hydroxy-5-deazariboflavin(1−) (CHEBI:59904) is conjugate base of 7,8-didemethyl-8-hydroxy-5-deazariboflavin (CHEBI:43034)
Incoming oxidised coenzyme F420-(γ-Glu)n polyanion (CHEBI:133980) has functional parent 7,8-didemethyl-8-hydroxy-5-deazariboflavin(1−) (CHEBI:59904)
7,8-didemethyl-8-hydroxy-5-deazariboflavin (CHEBI:43034) is conjugate acid of 7,8-didemethyl-8-hydroxy-5-deazariboflavin(1−) (CHEBI:59904)
IUPAC Name
1-deoxy-1-(8-hydroxy-2,4-dioxo-2H-pyrimido[4,5-b]quinolin-3-id-10(4H)-yl)-D-ribitol
Synonyms Sources
7,8-didemethyl-8-hydroxy-5-deazariboflavin UniProt
7,8-didemethyl-8-hydroxy-5-deazariboflavin anion ChEBI
7,8-didemethyl-8-hydroxy-5-deazariboflavin-3-ide ChEBI
Last Modified
13 August 2010