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Details of 3,4-Dihydroxybenzylamine

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Role	Metabolite
MPIMP ID	M000326
stereoisomer	no
isotopomer	ambient
formula	C7H9NO2
molecular mass	139.152
monoisotopic mass	139.06333
InChI	InChI=1S/C7H9NO2/c8-4-5-1-2-6(9)7(10)3-5/h1-3,9-10H,4,8H2
InChIKey	YFMPSMITLLBENU-UHFFFAOYSA-N
class	Amine (Aromatic)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%2774875c42-3c45-4d9c-a7ec-69ed5f375d69%27)

Synonyms of 3,4-Dihydroxybenzylamine

property	value
BRENDA	25381
CAS	37491-68-2
ChemSpider ID	82729
MAPMAN	3,4-Dihydroxybenzylamine
PubChem CID	91623
PubChem SID	92297981
synonym	1,2-Benzenediol, 4-(aminomethyl)-
synonym	3,4-Dihydroxybenzylamine
synonym	Benzylamine, 3,4-dihydroxy-
9 synonym(s)

Derivatives of 3,4-Dihydroxybenzylamine

analyte	stereoisomer	isotopomer
NA		ambient
3,4-Dihydroxybenzylamine (4TMS)		ambient
2 analyte(s)

Reference substances of 3,4-Dihydroxybenzylamine

reference substance	supplier	supplier code	lot
3,4-Dihydroxybenzylamine hydrobromide	Fluka	37616	311548/1
1 reference substance(s)

Isotopomers and stereoisomers of 3,4-Dihydroxybenzylamine

metabolite	stereoisomer	isotopomer
no hits!

Quantitative 3,4-Dihydroxybenzylamine 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-Dihydroxybenzylamine 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	Strehmel N., Hummel J.

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