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Details of Quinoline-2-carboxylic acid, 4,8-dihydroxy- (3TMS)

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Role Analyte
nameQuinoline-2-carboxylic acid, 4,8-dihydroxy- (3TMS)
MPIMP IDA226011
isotopomerambient
formulaC19H31NO4Si3
molecular mass421.711
monoisotopic mass421.15609
InChIInChI=1S/C19H31NO4Si3/c1-25(2,3)22-16-12-10-11-14-17(23-26(4,5)6)13-15(20-18(14)16)19(21)24-27(7,8)9/h10-13H,1-9H3
InChIKeyYLJWZSLESGYQOM-UHFFFAOYSA-N
substructure TMS3
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)2,263.37
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%271c480b49-7a91-4cf6-8f08-7d383593fe1d%27)

Synonyms of Quinoline-2-carboxylic acid, 4,8-dihydroxy- (3TMS)

propertyvalue
ChemSpider ID460788
PubChem CID528697
synonymB000954
synonymQuinoline-2-carboxylic acid, 4,8-dihydroxy- (3TMS)
4 synonym(s)

Metabolite mapped to Quinoline-2-carboxylic acid, 4,8-dihydroxy- (3TMS)

Reference spectra of Quinoline-2-carboxylic acid, 4,8-dihydroxy- (3TMS)

replicaentry datedetectionmethodspecies
17/19/2007 11:16:30 AM MDN35Reference Substance
27/19/2007 11:16:30 AM VAR5Reference Substance
33/30/2011 4:52:37 PM Fiehn_GC_2010 
58/28/2012 5:51:49 PM MassBank GC 2010 Tsujimoto 
43/30/2011 4:52:37 PM Fiehn_GC_2010 
5 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
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