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Details of Kestose, 6- (11TMS)

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Role Analyte
nameKestose, 6- (11TMS)
MPIMP IDA341001
isotopomerambient
formulaC51H120O16Si11
molecular mass1,298.430
monoisotopic mass1,296.60384
InChIInChI=1S/C51H120O16Si11/c1-68(2,3)53-35-39-42(61-72(13,14)15)45(64-75(22,23)24)46(65-76(25,26)27)49(57-39)60-51(38-56-71(10,11)12)48(67-78(31,32)33)43(62-73(16,17)18)40(59-51)34-52-50(37-55-70(7,8)9)47(66-77(28,29)30)44(63-74(19,20)21)41(58-50)36-54-69(4,5)6/h39-49H,34-38H2,1-33H3/t39?,40?,41?,42-,43-,44-,45+,46-,47+,48+,49-,50-,51+/m1/s1
InChIKeyUEZRRYWSWNNXAJ-UNCPPWSYSA-N
substructure TMS1
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)3,381.36
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%278808a862-c84d-470f-ab69-d84cba6c5070%27)

Synonyms of Kestose, 6- (11TMS)

propertyvalue
synonymKestose, 6- (11TMS)
1 synonym(s)

Metabolite mapped to Kestose, 6- (11TMS)

metabolitestereoisomerisotopomer
Kestose, 6-  ambient
1 metabolite(s)

Reference spectra of Kestose, 6- (11TMS)

replicaentry datedetectionmethodspecies
18/1/2001 12:00:00 AM M[2]Standard
21/22/2005 12:00:00 AM M[ROE] 
2 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 Kopka J., Hummel J.
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