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Details of Ajmaline (2TMS)

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Role Analyte
nameAjmaline (2TMS)
MPIMP IDA269014
isotopomerambient
formulaC26H42N2O2Si2
molecular mass470.796
monoisotopic mass470.27848
InChIInChI=1S/C26H42N2O2Si2/c1-9-16-17-14-20-23-26(18-12-10-11-13-19(18)27(23)2)15-21(22(17)24(26)29-31(3,4)5)28(20)25(16)30-32(6,7)8/h10-13,16-17,20-25H,9,14-15H2,1-8H3/t16-,17-,20-,21-,22-,23-,24+,25+,26-/m0/s1
InChIKeyCSZKZWFZXLUQQY-RJYRIRGPSA-N
substructure TMS2
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)2,694.57
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27bfc42173-59ff-4de8-9204-aa55a5f5ace2%27)

Synonyms of Ajmaline (2TMS)

propertyvalue
synonymAjmaline (2TMS)
synonymB000070
2 synonym(s)

Metabolite mapped to Ajmaline (2TMS)

metabolitestereoisomerisotopomer
Ajmaline  ambient
1 metabolite(s)

Reference spectra of Ajmaline (2TMS)

replicaentry datedetectionmethodspecies
17/19/2007 11:16:30 AM VAR5Reference Substance
27/19/2007 11:16:30 AM MDN35Reference Substance
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 Hummel J.
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
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