GOLM METABOLOME DATABASE

- home
- search
- ms analysis
  - library search
  - prediction
- GoBioSpace
- blog
- thanks to
- publications
- imprint
- privacy policy
- contact
- help

The GMD web site use latest HTML5 features! This message indicates backward compatibility problems in GMD's mass spectra, chemical compound structure and metabolite profile visualizations. As your browser does not support the HTML5 <canvas> element, please consider to upgrade to a HTML5 ready web browser, including Microsoft Internet Explorer, Mozilla Firefox, Apple Safari, Google Chrome and Opera, to fully enjoy GMD's functionalities!

Details of Acetonitrile, 4-hydroxyphenyl-

rotate: click+drag; translate: alt+click+drag; zoom: mousewheel; save: mol

Role	Metabolite
MPIMP ID	M000946
stereoisomer
isotopomer	ambient
formula	C8H7NO
molecular mass	133.148
monoisotopic mass	133.05276
InChI	InChI=1S/C8H7NO/c9-6-5-7-1-3-8(10)4-2-7/h1-4,10H,5H2
InChIKey	AYKYOOPFBCOXSL-UHFFFAOYSA-N
class
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%277898c7a4-5d46-437f-8474-b1e83f66afe5%27)

Synonyms of Acetonitrile, 4-hydroxyphenyl-

property	value
BRENDA	26524
ChEBI ID	ChEBI:16667
ChEBI ontology	is a hydroxynitrile
ChemSpider ID	24729
MetaCyc	CPD-1074
PubChem CID	26548
PubChem SID	92298336
synonym	(4-hydroxyphenyl)acetonitrile
synonym	4-Hydroxybenzeneacetonitrile
synonym	4-Hydroxybenzyl cyanide
14 synonym(s)
Page of 2 Results per page:

Derivatives of Acetonitrile, 4-hydroxyphenyl-

analyte	stereoisomer	isotopomer
Acetonitrile, 4-hydroxyphenyl- (1TMS)		ambient
1 analyte(s)

Reference substances of Acetonitrile, 4-hydroxyphenyl-

reference substance	supplier	supplier code	lot
No Reference substances found!

Isotopomers and stereoisomers of Acetonitrile, 4-hydroxyphenyl-

metabolite	stereoisomer	isotopomer
no hits!

Quantitative Acetonitrile, 4-hydroxyphenyl- 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 Acetonitrile, 4-hydroxyphenyl- Profile Data

species
no qualitative metabolite profile data available!

compound timestamp information
deposited	at 4/14/2009 by Strehmel N., Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
last changed	at 8/7/2013 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.

Show all metabolites

Top