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Details of Orotic acid, 4,5-dihydro- (3TMS)

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Role	Analyte
name	Orotic acid, 4,5-dihydro- (3TMS)
MPIMP ID	A178007
isotopomer	ambient
formula	C14H30N2O4Si3
molecular mass	374.656
monoisotopic mass	374.15134
InChI	InChI=1S/C14H30N2O4Si3/c1-21(2,3)15-11(13(18)20-23(7,8)9)10-12(17)16(14(15)19)22(4,5)6/h11H,10H2,1-9H3/t11-/m0/s1
InChIKey	XMQDORXEQQGXDY-NSHDSACASA-N
substructure TMS	3
substructure TBS	0
substructure H3ON	0
substructure CH3O	0
retention index (VAR5 method, n-alkanes C10–C36)	1,771.73
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27c15940a9-9f78-4c3e-97e1-5e79abc84139%27)

Synonyms of Orotic acid, 4,5-dihydro- (3TMS)

property	value
no synonym(s) available!

Metabolite mapped to Orotic acid, 4,5-dihydro- (3TMS)

metabolite	stereoisomer	isotopomer
Orotic acid, 4,5-dihydro-	L-	ambient
Orotic acid, 4,5-dihydro-	DL-	ambient
2 metabolite(s)

Reference spectra of Orotic acid, 4,5-dihydro- (3TMS)

replica	entry date	method	species
1	7/19/2007 11:16:30 AM	VAR5	Reference Substance
6	11/3/2010 4:21:38 PM	Schomburg_GC_2010
7	8/28/2012 5:51:49 PM	MassBank GC 2010 Tsujimoto
2	7/19/2007 11:16:30 AM	MDN35	Reference Substance
8	8/28/2012 5:51:49 PM	MassBank GC 2010 Tsujimoto
3	7/19/2007 11:16:30 AM	MDN35	Reference Substance
4	12/16/2003 12:00:00 AM	M[2]	Standard
9	8/28/2012 5:51:49 PM	MassBank GC 2010 Tsujimoto
5	7/19/2007 11:16:30 AM	VAR5	Reference Substance
9 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 8/15/2012 by Kopka J., 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	Hummel J., Kopka J.

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