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Details of Gallic acid ethyl ester

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Role	Metabolite
MPIMP ID	M000803
stereoisomer
isotopomer	ambient
formula	C9H10O5
molecular mass	198.173
monoisotopic mass	198.05283
InChI	InChI=1S/C9H10O5/c1-2-14-9(13)5-3-6(10)8(12)7(11)4-5/h3-4,10-12H,2H2,1H3
InChIKey	VFPFQHQNJCMNBZ-UHFFFAOYSA-N
class	Acid (Aromatic)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%276359f896-3057-40aa-81cd-5734dce29c20%27)

Synonyms of Gallic acid ethyl ester

property	value
BRENDA	72133
CAS	831-61-8
ChEBI ID	ChEBI:550862
ChemSpider ID	12693
PubChem CID	13250
PubChem SID	92297874
synonym	Benzoic acid, 3,4,5-trihydroxy-, ethyl ester
synonym	Ethyl 3,4,5-trihydroxybenzoate
synonym	ethyl gallate
synonym	ethylgallate
11 synonym(s)
Page of 2 Results per page:

Derivatives of Gallic acid ethyl ester

analyte	stereoisomer	isotopomer
Gallic acid ethyl ester (3TMS)		ambient
1 analyte(s)

Reference substances of Gallic acid ethyl ester

reference substance	supplier	supplier code	lot
Propyl gallate	Fluka	RA13241	453882/1
Propyl gallate	Fluka	48710
Propyl gallate	Fluka	48710
3 reference substance(s)

Isotopomers and stereoisomers of Gallic acid ethyl ester

metabolite	stereoisomer	isotopomer
no hits!

Quantitative Gallic acid ethyl ester 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 Gallic acid ethyl ester 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 5/21/2012 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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