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Details of Propanoic acid, 3-(2,4-dihydroxyphenyl)-

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Role	Metabolite
MPIMP ID	M000210
stereoisomer	no
isotopomer	ambient
formula	C9H10O4
molecular mass	182.174
monoisotopic mass	182.05791
InChI	InChI=1S/C9H10O4/c10-7-3-1-6(8(11)5-7)2-4-9(12)13/h1,3,5,10-11H,2,4H2,(H,12,13)
InChIKey	HMCMTJPPXSGYJY-UHFFFAOYSA-N
class	Acid (Phenylpropanoic)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%272e7ebb5a-9f35-48ae-8361-557f93800936%27)

Synonyms of Propanoic acid, 3-(2,4-dihydroxyphenyl)-

property	value
CAS	5631-68-5
ChEBI ID	ChEBI:478402
ChemSpider ID	87007
MAPMAN	3-(2,4-Dihydoxyphenyl)propionate
PubChem CID	96384
PubChem SID	92297867
synonym	2,4-Dihydroxyhydrocinnamic acid
synonym	3-(2,4-dihydroxyphenyl)propionic acid
synonym	Propanoic acid, 3-(2,4-dihydroxyphenyl)-
synonym	Tropane
10 synonym(s)

Derivatives of Propanoic acid, 3-(2,4-dihydroxyphenyl)-

analyte	stereoisomer	isotopomer
3-(2,4-Dihydroxyphenyl)-propanoic acid (3TMS)	no	ambient
1 analyte(s)

Reference substances of Propanoic acid, 3-(2,4-dihydroxyphenyl)-

reference substance	supplier	supplier code	lot
Propanoic acid, 3-(2,4-dihydroxyphenyl)-	Fluka	37870	42177/1
1 reference substance(s)

Isotopomers and stereoisomers of Propanoic acid, 3-(2,4-dihydroxyphenyl)-

metabolite	stereoisomer	isotopomer
no hits!

Quantitative Propanoic acid, 3-(2,4-dihydroxyphenyl)- 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 Propanoic acid, 3-(2,4-dihydroxyphenyl)- Profile Data

species
no qualitative metabolite profile data available!

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 8/11/2011 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users	Strehmel N., Hummel J.

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