CHEBI:140157 - 8-carboxy-8-demethylriboflavin 5'-phosphate

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ChEBI Name 8-carboxy-8-demethylriboflavin 5'-phosphate
ChEBI ID CHEBI:140157
Definition A flavin mononucleotide that is FMN in which the 8-methyl group has been oxidised to the corresponding carboxylic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C17H19N4O11P
Net Charge 0
Average Mass 486.327
Monoisotopic Mass 486.07879
InChI InChI=1S/C17H19N4O11P/c1-6-2-8-9(3-7(6)16(26)27)21(14-12(18-8)15(25)20-17(28)19-14)4-10(22)13(24)11(23)5-32-33(29,30)31/h2-3,10-11,13,22-24H,4-5H2,1H3,(H,26,27)(H,20,25,28)(H2,29,30,31)/t10-,11+,13-/m0/s1
InChIKey IJHPVGHUQIMRPT-LOWVWBTDSA-N
SMILES C(N1C=2C(=NC3=C1C=C(C(=C3)C)C(=O)O)C(NC(N2)=O)=O)[C@H](O)[C@H](O)[C@H](O)COP(O)(=O)O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): cofactor
An organic molecule or ion (usually a metal ion) that is required by an enzyme for its activity. It may be attached either loosely (coenzyme) or tightly (prosthetic group).
(via flavin mononucleotide )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 8-carboxy-8-demethylriboflavin 5'-phosphate (CHEBI:140157) has functional parent FMN (CHEBI:17621)
8-carboxy-8-demethylriboflavin 5'-phosphate (CHEBI:140157) is a aromatic carboxylic acid (CHEBI:33859)
8-carboxy-8-demethylriboflavin 5'-phosphate (CHEBI:140157) is a flavin mononucleotide (CHEBI:24041)
8-carboxy-8-demethylriboflavin 5'-phosphate (CHEBI:140157) is a ribitol phosphate (CHEBI:26554)
8-carboxy-8-demethylriboflavin 5'-phosphate (CHEBI:140157) is conjugate acid of 8-carboxy-8-demethylriboflavin 5'-phosphate(4−) (CHEBI:139571)
Incoming 8-carboxy-8-demethylriboflavin 5'-phosphate(4−) (CHEBI:139571) is conjugate base of 8-carboxy-8-demethylriboflavin 5'-phosphate (CHEBI:140157)
IUPAC Name
1-(8-carboxy-7-methyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-1-deoxy-5-O-phosphono-D-ribitol
Manual Xref Database
CPD-19837 MetaCyc
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Last Modified
14 February 2018