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Details of 3,4-Dihydroxyphenylacetic acid

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Role	Metabolite
MPIMP ID	M000864
stereoisomer	no
isotopomer	ambient
formula	C8H8O4
molecular mass	168.147
monoisotopic mass	168.04226
InChI	InChI=1S/C8H8O4/c9-6-2-1-5(3-7(6)10)4-8(11)12/h1-3,9-10H,4H2,(H,11,12)
InChIKey	CFFZDZCDUFSOFZ-UHFFFAOYSA-N
class	Acid (Aromatic)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%2747115c80-8c82-419a-bc51-b10a2cb7fe8f%27)

Synonyms of 3,4-Dihydroxyphenylacetic acid

property	value
BRENDA	26719
CAS	102-32-9
ChEBI ID	ChEBI:41941
ChEBI ontology	has functional parent phenylacetic acid
ChEBI ontology	is a dihydroxyphenylacetic acid
ChEBI ontology	is conjugate acid of (3,4-dihydroxyphenyl)acetate
ChemSpider ID	532
PubChem CID	547
PubChem SID	92298330
synonym	(3,4-dihydroxyphenyl)acetic acid
16 synonym(s)
Page of 2 Results per page:

Derivatives of 3,4-Dihydroxyphenylacetic acid

analyte	stereoisomer	isotopomer
Acetic acid, 3,4-dihydroxyphenyl- (3TMS)	no	ambient
1 analyte(s)

Reference substances of 3,4-Dihydroxyphenylacetic acid

reference substance	supplier	supplier code	lot
3,4-Dihydroxyphenylacetic acid	Aldrich	850217
3,4-Dihydroxyphenylacetic acid	Aldrich	850217
3,4-Dihydroxyphenylacetic acid	Aldrich	850217	S23418-404
3 reference substance(s)

Isotopomers and stereoisomers of 3,4-Dihydroxyphenylacetic acid

metabolite	stereoisomer	isotopomer
no hits!

Quantitative 3,4-Dihydroxyphenylacetic 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 3,4-Dihydroxyphenylacetic acid 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	Kopka J., Strehmel N., Hummel J.

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