GOLM METABOLOME DATABASE

Details of Glutaric acid, 3-hydroxy-3-methyl- (3TMS)

rotate: click+drag; translate: alt+click+drag; zoom: mousewheel; save: mol
Role Analyte
nameGlutaric acid, 3-hydroxy-3-methyl- (3TMS)
MPIMP IDA161003
isotopomerambient
formulaC15H34O5Si3
molecular mass378.684
monoisotopic mass378.17141
InChIInChI=1S/C15H34O5Si3/c1-15(20-23(8,9)10,11-13(16)18-21(2,3)4)12-14(17)19-22(5,6)7/h11-12H2,1-10H3
InChIKeySWDDFRVEZJUJJD-UHFFFAOYSA-N
substructure TMS 
substructure TBS0
substructure H3ON 
substructure CH3O 
retention index (VAR5 method, n-alkanes C10–C36)1,598.69
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%273532636a-b671-4d38-bba5-21b1313d30dc%27)

Synonyms of Glutaric acid, 3-hydroxy-3-methyl- (3TMS)

propertyvalue
ChemSpider ID455052
PubChem CID521668
2 synonym(s)

Metabolite mapped to Glutaric acid, 3-hydroxy-3-methyl- (3TMS)

Reference spectra of Glutaric acid, 3-hydroxy-3-methyl- (3TMS)

replicaentry datedetectionmethodspecies
68/28/2012 5:51:49 PM MassBank GC 2010 Tsujimoto 
17/19/2007 11:16:30 AM MDN35Reference Substance
76/5/2013 12:39:00 PM MRI_2013 
53/30/2011 4:52:37 PM Fiehn_GC_2010 
211/1/2001 12:00:00 AM M[2]Standard
35/1/2001 12:00:00 AM M[EIGTMS]Standard Addition
47/19/2007 11:16:30 AM VAR5Reference Substance
7 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 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
Top