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Details of Pyridoxine (3TMS)

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Role Analyte
namePyridoxine (3TMS)
MPIMP IDA189017
isotopomerambient
formulaC17H35NO3Si3
molecular mass385.722
monoisotopic mass385.19247
InChIInChI=1S/C17H35NO3Si3/c1-14-17(21-24(8,9)10)16(13-20-23(5,6)7)15(11-18-14)12-19-22(2,3)4/h11H,12-13H2,1-10H3
InChIKeySMDRDHCUJYPMJH-UHFFFAOYSA-N
substructure TMS3
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,891.46
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27d4c5bdd4-49bb-4da5-b213-1a197322589e%27)

Synonyms of Pyridoxine (3TMS)

propertyvalue
ChemSpider ID452749
PubChem CID519017
2 synonym(s)

Metabolite mapped to Pyridoxine (3TMS)

metabolitestereoisomerisotopomer
Pyridoxin  ambient
1 metabolite(s)

Reference spectra of Pyridoxine (3TMS)

replicaentry datedetectionmethodspecies
17/19/2007 11:16:30 AM MDN35Reference Substance
611/3/2010 4:22:59 PM Schomburg_GC_2010 
27/19/2007 11:16:30 AM VAR5Reference Substance
108/28/2012 5:51:49 PM MassBank GC 2010 Ara 
98/28/2012 5:51:49 PM MassBank GC 2010 Tsujimoto 
88/28/2012 5:51:49 PM MassBank GC 2010 Kusano 
35/12/2005 12:00:00 AM M[NIST] 
73/30/2011 4:52:37 PM Fiehn_GC_2010 
411/26/2004 12:00:00 AM M[FAME4090]Standard
55/12/2005 12:00:00 AM M[NIST] 
10 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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