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Details of Sucrose (8TMS)

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Role Analyte
nameSucrose (8TMS)
MPIMP IDA264001
isotopomerambient
formulaC36H86O11Si8
molecular mass919.746
monoisotopic mass918.43243
InChIInChI=1S/C36H86O11Si8/c1-48(2,3)37-25-28-30(43-51(10,11)12)32(45-53(16,17)18)33(46-54(19,20)21)35(40-28)42-36(27-39-50(7,8)9)34(47-55(22,23)24)31(44-52(13,14)15)29(41-36)26-38-49(4,5)6/h28-35H,25-27H2,1-24H3/t28-,29-,30-,31-,32+,33-,34+,35-,36+/m1/s1
InChIKeyJDAONBLATRVCRV-YYEYMFTQSA-N
substructure TMS8
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)2,623.04
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%2719eba91e-4d0e-493e-8297-3466769c0c1b%27)

Synonyms of Sucrose (8TMS)

propertyvalue
ChemSpider ID9106249
PubChem CID632328
2 synonym(s)

Metabolite mapped to Sucrose (8TMS)

metabolitestereoisomerisotopomer
SucroseDL- ambient
1 metabolite(s)

Reference spectra of Sucrose (8TMS)

replicaentry datedetectionmethodspecies
12/22/2005 12:00:00 AM M[STR] 
408/28/2012 5:51:49 PM MassBank GC 2010 Kusano 
210/12/2005 12:00:00 AM M[BAR] 
41/25/2005 12:00:00 AM M[MOR] 
510/5/2004 12:00:00 AM M[2]Standard
363/17/2010 4:47:46 PM VAR5Brassica oleracea
611/26/2004 12:00:00 AM M[FAME4090]Standard
73/15/2005 12:00:00 AM M[6]Reference Substance
3811/3/2010 4:22:54 PM Schomburg_GC_2010 
87/19/2007 11:16:30 AM VAR5Reference Substance
35 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 8/11/2011 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Hummel J.
service last updated 04/12/2020 © 2008-2014 Golm Metabolome Database - All rights reserved
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