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Details of Nicotinuric acid (1TMS)

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Role	Analyte
name	Nicotinuric acid (1TMS)
MPIMP ID	A188036
isotopomer	ambient
formula
molecular mass
monoisotopic mass
InChI
InChIKey
substructure TMS
substructure TBS
substructure H3ON
substructure CH3O
retention index (VAR5 method, n-alkanes C10–C36)	1,886.03
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%2712f519b1-7658-4ebe-afda-aa5ddc124d4f%27)

Synonyms of Nicotinuric acid (1TMS)

property	value
synonym	[68499] nicotinoylglycine [17.348]
1 synonym(s)

Metabolite mapped to Nicotinuric acid (1TMS)

metabolite	stereoisomer	isotopomer
Nicotinuric acid		ambient
1 metabolite(s)

Reference spectra of Nicotinuric acid (1TMS)

replica	entry date	detection	method	species
1	3/30/2011 4:52:37 PM		Fiehn_GC_2010
1 spectrum(a)

compound timestamp information
deposited	at 3/28/2011 by Kopka J., Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
last changed	at 12/20/2012 by Kopka J., Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
modified by users	Kopka J.

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