RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet IDRM0049341
RefMet nameAmidosulfuron
Systematic name1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea
SynonymsPubChem Synonyms
Exact mass369.041294 (neutral)
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View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC9H15N5O7S2View other entries in RefMet with this formula
Molecular descriptors
Molfile67995 (Download molfile/View MW Metabolite Database details)
InChIInChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)
InChIKeyCTTHWASMBLQOFR-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
SMILESCN(S(=O)(=O)C)S(=O)(=O)NC(=O)Nc1nc(cc(n1)OC)OC
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Chemical/Biochemical Classification
Super ClassOrganic oxygen compounds
Main ClassOrganooxygen compounds
Sub ClassEthers
Distribution of Amidosulfuron in NMDR studies
SpeciesPlot Species distribution
Sample sourcePlot Sample source(tissue) distribution
PlatformPlatform (MS/NMR) used for detection
ChromatographyChromatography methods used for detection
StudiesNMDR Studies reporting Amidosulfuron
External Links
Pubchem CID91777
ChEBI ID2635
KEGG IDC10933
EPA CompToxDTXCID5031713
Spectral data for Amidosulfuron standards
MassBank(EU)View MS spectra
Structural annotation level
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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