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Details of Docosahexaenoic acid, 4,7,10,13,16,19-(Z,Z,Z,Z,Z,Z)- (1TMS)

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Role Analyte
nameDocosahexaenoic acid, 4,7,10,13,16,19-(Z,Z,Z,Z,Z,Z)- (1TMS)
MPIMP IDA257010
isotopomerambient
formulaC25H40O2Si
molecular mass400.670
monoisotopic mass400.27976
InChIInChI=1S/C25H40O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(26)27-28(2,3)4/h6-7,9-10,12-13,15-16,18-19,21-22H,5,8,11,14,17,20,23-24H2,1-4H3/b7-6-,10-9-,13-12-,16-15-,19-18-,22-21-
InChIKeyWKGLYXNPWPPKPA-WSDBEMKQSA-N
substructure TMS1
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)2,575.85
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27e94c90a8-c8c6-4734-a25e-ce6f7d1d3a4f%27)

Synonyms of Docosahexaenoic acid, 4,7,10,13,16,19-(Z,Z,Z,Z,Z,Z)- (1TMS)

propertyvalue
no synonym(s) available!

Metabolite mapped to Docosahexaenoic acid, 4,7,10,13,16,19-(Z,Z,Z,Z,Z,Z)- (1TMS)

Reference spectra of Docosahexaenoic acid, 4,7,10,13,16,19-(Z,Z,Z,Z,Z,Z)- (1TMS)

replicaentry datedetectionmethodspecies
17/19/2007 11:16:30 AM VAR5Reference Substance
21/25/2005 12:00:00 AM M[MOR] 
37/19/2007 11:16:30 AM MDN35Reference Substance
3 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.
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