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Details of Nicotinic acid

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Role	Metabolite
MPIMP ID	M000457
stereoisomer
isotopomer	ambient
formula	C6H5NO2
molecular mass	123.110
monoisotopic mass	123.03203
InChI	InChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9)
InChIKey	PVNIIMVLHYAWGP-UHFFFAOYSA-N
class	Acid (N-heterocycle)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%273ddb011e-f3a6-45b6-a2d2-77b2a6e8936e%27)

Synonyms of Nicotinic acid

property	value
Beilstein	109591
BRENDA	36382
CAS	59-67-6
ChEBI ID	ChEBI:15940
ChEBI ontology	has role antidote
ChEBI ontology	has role antilipemic drug
ChEBI ontology	has role vasodilator agent
ChEBI ontology	has role vitamin
ChEBI ontology	is a pyridine alkaloid
ChEBI ontology	is a pyridinemonocarboxylic acid
34 synonym(s)
Page of 4 Results per page:

Derivatives of Nicotinic acid

analyte	stereoisomer	isotopomer
Nicotinic acid (1TMS)		ambient
NICOTINIC ACID,TBS 1X		ambient
Nicotinic acid (1TMS)		¹³C
3 analyte(s)

Reference substances of Nicotinic acid

reference substance	supplier	supplier code	lot
Nicotinic acid	Merck	481918	K90134405 404
Nicotinic acid	Wako	142-01232
2 reference substance(s)

Isotopomers and stereoisomers of Nicotinic acid

metabolite	stereoisomer	isotopomer
Nicotinic acid		¹³C
1 metabolite(s)

Quantitative Nicotinic acid Profile Data

Each graph visualises metabolite concentrations across a single metabolite profiling experiment. Each box plot represents relative (normalised) metabolite concentrations for single replica groups in the specific metabolite profiling experiment.

Name	Organism	Factor	Variance	Anova F score
Mining for metabolic responses to long-term salt stress: a case study on Arabidopsis thaliana Col-0 (C)	Arabidopsis	Salt	353.98	2.08
Mining for metabolic responses to long-term salt stress: a case study on Arabidopsis thaliana Col-0 (A)	Arabidopsis	Salt	186.70	1.93
Mining for metabolic responses to long-term salt stress: a case study on the model legume Lotus japonicus (B)	Lotus	Salt	192.87	1.03
metabolic changes during developmental senescence: a case study on Arabidopsis thaliana (single leaves)	Arabidopsis	Material, Time, Total Light	385.96	0.99
Mining for metabolic responses to long-term salt stress: a case study on the model legume Lotus japonicus (A)	Lotus	Salt	223.68	0.79
Mining for metabolic responses to long-term salt stress: a case study on the model legume Lotus japonicus (C)	Lotus	Salt	448.70	0.45
Mining for metabolic responses to long-term salt stress: a case study on Arabidopsis thaliana Col-0 (B)	Arabidopsis	Salt	342.62	0.27
7 quantitative metabolite profile(s)

Qualitative Nicotinic acid Profile Data

species
Arabidopsis thaliana.Col-0
Lotus Japonicus.Gifu
this metabolite was recorded in 2 species

compound timestamp information
deposited	at 8/29/2006 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed	at 11/26/2013 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users	Kopka J., Boelling C., Hummel J.

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