P-toluenesulfonic Acid - InChI=1S/C7H8O3S.H2O/c1-6-2-4-7 ... - GMD

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Details of p-toluenesulfonic acid rotate: click+drag; translate: alt+click+drag; zoom: mousewheel; save: mol

Role	Metabolite
MPIMP ID	M001685
stereoisomer
isotopomer	ambient
formula	C7H8O3S.H2O
molecular mass	190.218
monoisotopic mass	190.02998
InChI	InChI=1S/C7H8O3S.H2O/c1-6-2-4-7(5-3-6)11(8,9)10;/h2-5H,1H3,(H,8,9,10);1H2
InChIKey	KJIFKLIQANRMOU-UHFFFAOYSA-N
class
application/atom+xml	http://gmd-dev.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%2703b5ecfc-9e9f-4307-a427-a3d97b4e89ba%27)

Synonyms of p-toluenesulfonic acid

property	value
CAS	6192-52-5
ChemSpider ID	455348
synonym	p-toluenesulfonic acid
3 synonym(s)

Derivatives of p-toluenesulfonic acid

analyte	stereoisomer	isotopomer
[6101] p-toluenesulfonic acid [14.265]	ambient
1 analyte(s)

Reference substances of p-toluenesulfonic acid

reference substance	supplier	supplier code	lot
No Reference substances found!

Isotopomers and stereoisomers of p-toluenesulfonic acid

metabolite	stereoisomer	isotopomer
no hits!

Quantitative p-toluenesulfonic 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	Heatmap	Box plot	Variance	Anova F score
no metabolite profile(s) found.

Qualitative p-toluenesulfonic acid Profile Data

species
no qualitative metabolite profile data available!

compound timestamp information
deposited	at 9/25/2012 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed	at 10/1/2012 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users	Hummel J.

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