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Details of Cystathionine, a mixture of 4 stereoisomers; L-, D-, L-allo- and D-allo-cystathionine

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Role	Metabolite
MPIMP ID	M000022
stereoisomer	DL-
isotopomer	ambient
formula	C7H14N2O4S
molecular mass	222.264
monoisotopic mass	222.06743
InChI	InChI=1S/C7H14N2O4S/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)
InChIKey	ILRYLPWNYFXEMH-UHFFFAOYSA-N
class	Acid (Amino)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%2798dc4da1-f0ca-4af2-9f85-dfa8c3b39303%27)

Synonyms of Cystathionine, a mixture of 4 stereoisomers; L-, D-, L-allo- and D-allo-cystathionine

property	value
CAS	535-34-2
ChEBI ID	ChEBI:17755
ChEBI ontology	has role secondary metabolite
ChEBI ontology	is a cystathionines
ChemSpider ID	811
MAPMAN	Cystathionine
PubChem CID	834
PubChem SID	24892630
PubChem SID	92298575
synonym	2-amino-4-[(2-amino-2-carboxyethyl)sulfanyl]butanoic acid
16 synonym(s)
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Derivatives of Cystathionine, a mixture of 4 stereoisomers; L-, D-, L-allo- and D-allo-cystathionine

analyte	stereoisomer	isotopomer
Cystathionine (2TMS)		ambient
Cystathionine (3TMS)		ambient
Cystathionine (4TMS)		ambient
3 analyte(s)

Reference substances of Cystathionine, a mixture of 4 stereoisomers; L-, D-, L-allo- and D-allo-cystathionine

reference substance	supplier	supplier code	lot
Cystathionine, a mixture of 4 stereoisomers; L-, D-, L-allo- and D-allo-cystathionine	Sigma	C3633
Cystathionine	Sigma	C7505	082K1321
Cystathionine, a mixture of 4 stereoisomers; L-, D-, L-allo- and D-allo-cystathionine	Sigma	C3633	59H3863
Cystathionine	Sigma	C7505	123K1240
Cystathionine	Wako	037-19521
5 reference substance(s)

Isotopomers and stereoisomers of Cystathionine, a mixture of 4 stereoisomers; L-, D-, L-allo- and D-allo-cystathionine

metabolite	stereoisomer	isotopomer
Cystathionine	L-	ambient
1 metabolite(s)

Quantitative Cystathionine, a mixture of 4 stereoisomers; L-, D-, L-allo- and D-allo-cystathionine 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 Cystathionine, a mixture of 4 stereoisomers; L-, D-, L-allo- and D-allo-cystathionine 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 10/1/2012 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users	Hummel J.

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