RefMet Compound Details

MW structure37845 (View MW Metabolite Database details)
RefMet nameFMN
Systematic name{[(2R,3S,4S)-5-{7,8-dimethyl-2,4-dioxo-2H,3H,4H,10H-benzo[g]pteridin-10-yl}-2,3,4-trihydroxypentyl]oxy}phosphonic acid
SMILESCc1cc2c(cc1C)N=C1C(=NC(=O)NC1=O)N2C[C@@H](O)[C@@H](O)[C@@H](O)COP(O)(O)=O
Exact mass456.104619 (neutral)
Calculate m/z:   
View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC17H21N4O9PView other entries in RefMet with this formula
InChIInChI=1S/C17H21N4O9P/c1-7-3-9-10(4-8(7)2)21(15-13(18-9)16(25)20-17(26)19-15)5-11(22)14(24)12(23)6-30-31(27,28)29/h3-4,11-12,14,22-24H,5-6H2,1-2H3,(H,20,25,26)(H2,27,28,29)/t11-,12+,14-/m0/s1
InChIKeyFVTCRASFADXXNN-SCRDCRAPSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassNucleic acids
Main ClassFlavins
Sub ClassFlavin nucleotides
Pubchem CID643976
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving FMN

Rxn IDKEGG ReactionEnzyme
R00160 FAD + H2O <=> AMP + FMNFAD nucleotidohydrolase
R00548 FMN + H2O <=> Riboflavin + Orthophosphateriboflavin-5-phosphate phosphohydrolase
R00549 ATP + Riboflavin <=> ADP + FMNATP:riboflavin 5'-phosphotransferase
R00161 ATP + FMN <=> Diphosphate + FADATP:FMN adenylyltransferase
R00550 D-Glucose 1-phosphate + Riboflavin <=> D-Glucose + FMND-Glucose-1-phosphate:riboflavin 5'-phosphotransferase
R08574 CTP + Riboflavin <=> CDP + FMNCTP:riboflavin 5'-phosphotransferase

Table of KEGG human pathways containing FMN

Pathway IDHuman Pathway# of reactions
hsa00740 Riboflavin metabolism 4
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