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Details of Acetaminophen

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Role	Metabolite
MPIMP ID	M000818
stereoisomer
isotopomer	ambient
formula	C8H9NO2
molecular mass	151.163
monoisotopic mass	151.06333
InChI	InChI=1S/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)
InChIKey	RZVAJINKPMORJF-UHFFFAOYSA-N
class	Alcohol (Aromatic, Amino)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%27f48b493f-b1fd-410c-aa0a-f40ec71a0689%27)

Synonyms of Acetaminophen

property	value
BRENDA	26793
CAS	103-90-2
ChEBI ID	ChEBI:46195
ChEBI ontology	has role cyclooxygenase 1 inhibitor
ChEBI ontology	has role cyclooxygenase 2 inhibitor
ChEBI ontology	is a acetamides
ChemSpider ID	1906
MetaCyc	CPD-7669
PubChem CID	1983
PubChem SID	92298667
29 synonym(s)
Page of 3 Results per page:

Derivatives of Acetaminophen

analyte	stereoisomer	isotopomer
Paracetamol (2TMS)		ambient
Paracetamol (1TMS)		ambient
2 analyte(s)

Reference substances of Acetaminophen

reference substance	supplier	supplier code
Acetaminophen	Aldrich	A 3035
Acetaminophen	Sigma-Aldrich	A7085-100G
Acetaminophen	Sigma	A5000
Acetaminophen
4 reference substance(s)

Isotopomers and stereoisomers of Acetaminophen

metabolite	stereoisomer	isotopomer
no hits!

Quantitative Acetaminophen 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 Acetaminophen 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 8/7/2013 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users	Fehrle I., Kopka J., Hummel J.

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