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Details of Glucoheptonic acid-1,4-lactone (5TMS)

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Role Analyte
nameGlucoheptonic acid-1,4-lactone (5TMS)
MPIMP IDA225012
isotopomerambient
formulaC22H52O7Si5
molecular mass569.072
monoisotopic mass568.25594
InChIInChI=1S/C22H52O7Si5/c1-30(2,3)24-16-17(26-31(4,5)6)18(27-32(7,8)9)19-20(28-33(10,11)12)21(22(23)25-19)29-34(13,14)15/h17-21H,16H2,1-15H3/t17-,18+,19-,20-,21-/m1/s1
InChIKeyPSGHGDZCHPRHRA-FDKIHUSFSA-N
substructure TMS5
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)2,113.47
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%271621ed72-5c31-4270-85d4-e307e7ab8e12%27)

Synonyms of Glucoheptonic acid-1,4-lactone (5TMS)

propertyvalue
no synonym(s) available!

Metabolite mapped to Glucoheptonic acid-1,4-lactone (5TMS)

Reference spectra of Glucoheptonic acid-1,4-lactone (5TMS)

replicaentry datedetectionmethodspecies
211/26/2004 12:00:00 AM M[FAME4090]Standard
43/30/2011 4:52:37 PM Fiehn_GC_2010 
56/5/2013 12:39:00 PM MRI_2013 
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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