MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

Feedback

5-fluorodeoxyuridine monophosphate

	Properties	Image
MNX_ID	MNXM38120
reference	chebi:2129
formula	C₉H₁₂FN₂O₈P
global charge	0
mol weight	326.173
InChIKey	HFEKDTCAMMOLQP-RRKCRQDMSA-N
InChI	InChI=1S/C9H12FN2O8P/c10-4-2-12(9(15)11-8(4)14)7-1-5(13)6(20-7)3-19-21(16,17)18/h2,5-7,13H,1,3H2,(H,11,14,15)(H2,16,17,18)/t5-,6+,7+/m0/s1
SMILES	O=C1NC(=O)N([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)C=C1F

MNX internals

InChI (mnx)	InChI=1/C9H12FN2O8P/c10-4-2-12(9(15)11-8(4)14)7-1-5(13)6(20-7)3-19-21(16,17)18/h2,5-7,13H,1,3H2,(H,11,14,15)(H2,16,17,18)/t5-,6+,7+/m0/s1
SMILES (mnx)	[CH2:1]1[C@H:5]([OH:13])[C@@H:6]([CH2:3][O:19][P:21]([OH:16])([OH:17])=[O:18])[O:20][C@H:7]1[N:12]1[CH:2]=[C:4]([F:10])[C:8]([OH:14])=[N:11][C:9]1=[O:15]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	1

Similar chemical compounds in external resources
Identifier	Description
CHEBI:2129 chebi:2129 HFEKDTCAMMOLQP-RRKCRQDMSA-N	5-fluorodeoxyuridine monophosphate 5-Fluorodeoxyuridine monophosphate
sabiork.compound:31547 sabiorkM:31547 HFEKDTCAMMOLQP-RRKCRQDMSA-N	5-F-dUMP 5-Fluoro-2'-deoxyuridine-5'-monophosphate
kegg.compound:C04242 keggC:C04242 HFEKDTCAMMOLQP-RRKCRQDMSA-N	5-Fluorodeoxyuridine monophosphate
seed.compound:cpd02607 seedM:cpd02607 HFEKDTCAMMOLQP-RRKCRQDMSA-L	5-Fluorodeoxyuridine monophosphate 2-fluoro-2-deoxy-uridine 5-monophosphate dUflMP
hmdb:HMDB0060394 HFEKDTCAMMOLQP-RRKCRQDMSA-N	5-Fluorodeoxyuridine monophosphate 5 Fluoro 2' deoxyuridine 5' monophosphate 5-FLUORODEOXYURIDYLic acid 5-Fluoro-2'-deoxyuridine-5'-monophosphate 5-Fluoro-2'-deoxyuridine-5'-monophosphoric acid 5-Fluoro-2-deoxyuridine monophosphate (fdump) 5-Fluoro-2-deoxyuridine monophosphoric acid (fdump) 5-Fluorodeoxyuridine monophosphoric acid FdUMP Fluorodeoxyuridylate [(2R,3S,5R)-5-(5-fluoro-2,4-dioxo-3H-pyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxyphosphonic acid {[(2R,3S,5R)-5-(5-fluoro-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy}phosphonic acid
vmhM:5fdourimp vmhmetabolite:5fdourimp HFEKDTCAMMOLQP-RRKCRQDMSA-N	5-Fluorodeoxyuridine monophosphate {[(2R,3S,5R)-5-(5-fluoro-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy}phosphonic acid
sabiork.compound:1800 sabiorkM:1800 HFEKDTCAMMOLQP-RRKCRQDMSA-N	5-fluorodeoxyuridine monophosphate
seed.compound:cpd24608 seedM:cpd24608 HFEKDTCAMMOLQP-RRKCRQDMSA-L	5-fluorodeoxyuridine monophosphate 2'-deoxy-5-fluoro-uridine 5'-monophosphate 2-fluoro-2-deoxy-uridine 5'-monophosphate F-dUMP fluorodeoxyuridylate
metacyc.compound:CPD-6061 metacycM:CPD-6061 HFEKDTCAMMOLQP-RRKCRQDMSA-L	F-dUMP 2'-deoxy-5-fluoro-uridine 5'-monophosphate 2-fluoro-2-deoxy-uridine 5'-monophosphate 5-fluorodeoxyuridine monophosphate dUflMP fluorodeoxyuridylate
hmdb:HMDB60394 keggC:M_C04242 seedM:M_cpd02607 seedM:M_cpd24608 vmhM:M_5fdourimp	secondary/obsolete/fantasy identifier