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Details of Glucoheptonic acid (7TMS)

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Role Analyte
nameGlucoheptonic acid (7TMS)
MPIMP IDA225006
isotopomerambient
formulaC28H70O8Si7
molecular mass731.450
monoisotopic mass730.34556
InChIInChI=1S/C28H70O8Si7/c1-37(2,3)30-22-23(31-38(4,5)6)24(32-39(7,8)9)25(33-40(10,11)12)26(34-41(13,14)15)27(35-42(16,17)18)28(29)36-43(19,20)21/h23-27H,22H2,1-21H3/t23-,24+,25-,26-,27-/m1/s1
InChIKeyUPRYONQLEJIRBX-UDLFFNGBSA-N
substructure TMS7
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)2,250.6
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27ab891930-9fe4-4138-a7f3-fb02d39908b4%27)

Synonyms of Glucoheptonic acid (7TMS)

propertyvalue
no synonym(s) available!

Metabolite mapped to Glucoheptonic acid (7TMS)

Reference spectra of Glucoheptonic acid (7TMS)

replicaentry datedetectionmethodspecies
111/26/2004 12:00:00 AM M[FAME4090]Standard
27/19/2007 11:16:30 AM VAR5Reference Substance
53/30/2011 4:52:37 PM Fiehn_GC_2010 
31/25/2005 12:00:00 AM M[MOR] 
47/19/2007 11:16:30 AM MDN35Reference Substance
66/5/2013 12:39:00 PM MRI_2013 
6 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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service last updated 31/08/2021 © 2008-2014 Golm Metabolome Database - All rights reserved
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