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Details of NA176025 (classified unknown)

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Role	Analyte
name	NA176025 (classified unknown)
MPIMP ID	A176025
isotopomer	ambient
formula
molecular mass
monoisotopic mass
InChI	InChI=1S/C15H34O5Si3/c1-21(2,3)17-11-14(20-23(7,8)9)12-10-13(15(16)18-12)19-22(4,5)6/h12-14H,10-11H2,1-9H3
InChIKey	VULQXPQZKLTTKL-UHFFFAOYSA-N
substructure TMS
substructure TBS
substructure H3ON
substructure CH3O
retention index (VAR5 method, n-alkanes C10–C36)	1,765.32
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27168cd5da-1563-461c-8fb8-2c967cd9dd74%27)

Synonyms of NA176025 (classified unknown)

property	value
ChemSpider ID	456519
Experiment [JKopka]	HTR_Glucose
Manual Interpretation [JKopka]	3-Deoxyhexonic acid-1,4-lactone (3TMS)\|JKopka\|C15H34O5Si3\|authenticated reference required\|METB:C6H10O5
Manual Match [JKopka]	700\|D-Ribo-Hexonic acid, 3-deoxy-2,5,6-tris-O-(trimethylsilyl)-, gamma-lactone\|NIST08\|CAS#:55570-78-0\|authenticated reference required\|METB:C6H10O5
synonym	NA176025 (classified unknown)
synonym	possible identification [3-Deoxyhexonic acid-1,4-lactone (3TMS)\|C15H34O5Si3]
synonym	possible identification [C6H10O5 (3TMS)\|C15H34O5Si3]
7 synonym(s)

Metabolite mapped to NA176025 (classified unknown)

metabolite	stereoisomer	isotopomer
no hits!

Reference spectra of NA176025 (classified unknown)

replica	entry date	method
2	1/7/2011 10:55:25 AM	VAR5
1	12/10/2010 9:14:39 AM	VAR5
2 spectrum(a)

compound timestamp information
deposited	at 1/14/2011 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
last changed	at 8/11/2011 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users	Kopka J., Hummel J.

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