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Details of TRANS-ACONITIC ACID, TBS 4X

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Role	Analyte
name	TRANS-ACONITIC ACID, TBS 4X
MPIMP ID	A000325
isotopomer	ambient
formula	C23H50O4Si3
molecular mass	474.898
monoisotopic mass	474.30169
InChI
InChIKey
substructure TMS	0
substructure TBS	4
substructure H3ON
substructure CH3O
retention index (VAR5 method, n-alkanes C10–C36)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27b9a01327-0621-4d6a-b03f-00f34b7fc234%27)

Synonyms of TRANS-ACONITIC ACID, TBS 4X

property	value
synonym	cis-aconitic acid,O,O,O-TBS
synonym	TRANS-ACONITIC ACID, TBS 4X
2 synonym(s)

Metabolite mapped to TRANS-ACONITIC ACID, TBS 4X

metabolite	stereoisomer	isotopomer
Aconitic acid, trans-	E-	ambient
1 metabolite(s)

Reference spectra of TRANS-ACONITIC ACID, TBS 4X

replica	entry date	detection	method	species
no spectra 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 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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