GOLM METABOLOME DATABASE

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Details of Docosenoic acid methyl ester, 13-(Z)-

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Role	Metabolite
MPIMP ID	M000766
stereoisomer	n-
isotopomer	ambient
formula	C23H44O2
molecular mass	352.595
monoisotopic mass	352.33413
InChI	InChI=1S/C23H44O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-2/h10-11H,3-9,12-22H2,1-2H3/b11-10-
InChIKey	ZYNDJIBBPLNPOW-KHPPLWFESA-N
class	Acid (Fatty acid methyl ester)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%27484a5d93-c760-4455-9e1e-882cfd6c2c73%27)

Synonyms of Docosenoic acid methyl ester, 13-(Z)-

property	value
CAS	1120-34-9
ChemSpider ID	4516577
PubChem CID	5364423
PubChem SID	92298133
synonym	Docosenoic acid methyl ester, 13-(Z)-
synonym	erucic acid ME (C22:1n9)
synonym	Erucic acid methyl ester
synonym	Erucic acid, methyl ester
8 synonym(s)

Derivatives of Docosenoic acid methyl ester, 13-(Z)-

analyte	stereoisomer	isotopomer
Docosenoic acid methyl ester, 13-(Z)-	n-	ambient
1 analyte(s)

Reference substances of Docosenoic acid methyl ester, 13-(Z)-

reference substance	supplier	supplier code	lot
Docosenoic acid methyl ester, 13-(Z)-	Sigma	E3510	28H5168
1 reference substance(s)

Isotopomers and stereoisomers of Docosenoic acid methyl ester, 13-(Z)-

metabolite	stereoisomer	isotopomer
no hits!

Quantitative Docosenoic acid methyl ester, 13-(Z)- 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 Docosenoic acid methyl ester, 13-(Z)- Profile Data

species
no qualitative metabolite profile data available!

compound timestamp information
deposited	at 7/16/2007 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed	at 9/24/2018 by Fehrle I., 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., Fehrle I.

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