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Details of Cystathionine (2TMS)

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Role	Analyte
name	Cystathionine (2TMS)
MPIMP ID	A213002
isotopomer	ambient
formula	C13H30N2O4SSi2
molecular mass	366.626
monoisotopic mass	366.14648
InChI	InChI=1S/C13H30N2O4SSi2/c1-21(2,3)18-12(16)10(14)7-8-20-9-11(15)13(17)19-22(4,5)6/h10-11H,7-9,14-15H2,1-6H3/t10-,11?/m0/s1
InChIKey	LMXNAZDQFPPNFU-VUWPPUDQSA-N
substructure TMS	2
substructure TBS	0
substructure H3ON	0
substructure CH3O	0
retention index (VAR5 method, n-alkanes C10–C36)	2,120.08
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%275dff153c-759b-434a-9345-51235cffdf31%27)

Synonyms of Cystathionine (2TMS)

property	value
no synonym(s) available!

Metabolite mapped to Cystathionine (2TMS)

metabolite	stereoisomer	isotopomer
Cystathionine	L-	ambient
Cystathionine, a mixture of 4 stereoisomers; L-, D-, L-allo- and D-allo-cystathionine	DL-	ambient
2 metabolite(s)

Reference spectra of Cystathionine (2TMS)

replica	entry date	method	species
2	5/12/2005 12:00:00 AM	M[NIST]
3	5/12/2005 12:00:00 AM	M[NIST]
4	7/19/2007 11:16:30 AM	VAR5	Reference Substance
3 spectrum(a)

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 8/9/2011 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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