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Details of 1-O-Benzoyl-beta-D-glucoside

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Role	Metabolite
MPIMP ID	M000325
stereoisomer	D-
isotopomer	ambient
formula	C13H16O7
molecular mass	284.262
monoisotopic mass	284.08961
InChI	InChI=1S/C13H16O7/c14-6-8-9(15)10(16)11(17)13(19-8)20-12(18)7-4-2-1-3-5-7/h1-5,8-11,13-17H,6H2
InChIKey	LVFCLUMIBMHAFL-UHFFFAOYSA-N
class	Sugar (Glucoside)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%27ce095283-fe91-4768-af33-001b082d8c03%27)

Synonyms of 1-O-Benzoyl-beta-D-glucoside

property	value
BRENDA	76530
CAS	21056-52-0
ChemSpider ID	278164
MAPMAN	1-O-Benzoyl-beta-glucoside
PubChem CID	314421
PubChem SID	92297405
synonym	1-O-Benzoyl-beta-D-glucoside
synonym	beta-D-Glucopyranose, 1-benzoate (9CI)
8 synonym(s)

Derivatives of 1-O-Benzoyl-beta-D-glucoside

analyte	stereoisomer	isotopomer
1-O-Benzoyl-beta-D-glucoside (4TMS)		ambient
1 analyte(s)

Reference substances of 1-O-Benzoyl-beta-D-glucoside

reference substance	supplier	supplier code
1-O-Benzyl-beta-D-glucoside	Aldrich	S963348
1-O-Benzyl-beta-D-glucoside	Aldrich	S963348
2 reference substance(s)

Isotopomers and stereoisomers of 1-O-Benzoyl-beta-D-glucoside

metabolite	stereoisomer	isotopomer
no hits!

Quantitative 1-O-Benzoyl-beta-D-glucoside 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 1-O-Benzoyl-beta-D-glucoside 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 12/19/2012 by Kopka J., Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
modified by users	Strehmel N., Hummel J., Kopka J.

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