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Details of Purine, 6-(3-hydroxybenzylamino)-

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Role	Metabolite
MPIMP ID	M000604
stereoisomer
isotopomer	ambient
formula	C12H11N5O
molecular mass	241.249
monoisotopic mass	241.09636
InChI	InChI=1S/C12H11N5O/c18-9-3-1-2-8(4-9)5-13-11-10-12(15-6-14-10)17-7-16-11/h1-4,6-7,18H,5H2,(H2,13,14,15,16,17)
InChIKey	BUDWTFCZGZYQHZ-UHFFFAOYSA-N
class	Purine (Cytokinine)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%2711f10b4c-4edd-4a56-852a-c6665f444d2f%27)

Synonyms of Purine, 6-(3-hydroxybenzylamino)-

property	value
BRENDA	37959
CAS	75737-38-1
ChemSpider ID	9732544
PubChem CID	11557770
PubChem SID	92298433
synonym	Phenol, 3-[(1H-purin-6-ylamino)methyl]-
synonym	Purine, 6-(3-hydroxybenzylamino)-
synonym	Topoline, meta-
8 synonym(s)

Derivatives of Purine, 6-(3-hydroxybenzylamino)-

analyte	stereoisomer	isotopomer
Purine, 6-(3-hydroxybenzylamino)- (2TBS)		ambient
Purine, 6-(3-hydroxybenzylamino)- (2TMS)		ambient
Purine, 6-(3-hydroxybenzylamino)- (3TMS)		ambient
Purine, 6-(3-hydroxybenzylamino)- (1TMS)		ambient
4 analyte(s)

Reference substances of Purine, 6-(3-hydroxybenzylamino)-

reference substance	supplier	supplier code	lot
Purine, 6-(3-hydroxybenzylamino)-	Degussa	T0941	000198
1 reference substance(s)

Isotopomers and stereoisomers of Purine, 6-(3-hydroxybenzylamino)-

metabolite	stereoisomer	isotopomer
no hits!

Quantitative Purine, 6-(3-hydroxybenzylamino)- 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 Purine, 6-(3-hydroxybenzylamino)- 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	Fehrle I., Hummel J.

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