Systematic / IUPAC Name: 1,3-Dihydroxy-2-propanyl (5Z,8Z,11Z)-13-(3-pentyl-2-oxiranyl)-5,8,11-tridecatrienoate
ID: Reference4758
Other Names:
2-14,15-EG;
1,3-Dihydroxypropan-2-yl (5Z,8Z,11Z)-13-(3-pentyloxiran-2-yl)trideca-5,8,11-trienoate;
5,8,11-Tridecatrienoic acid, 13-(3-pentyloxiranyl)-, 2-hydroxy-1-(hydroxymethyl)ethyl ester, (5Z,8Z,11Z)-
Formula: C23H38O5
Class: Endogenous Metabolites
2-(14,15-Epoxyeicosatrienoyl) glycerol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Elite |
No. of Spectral Trees | 1 |
No. of Spectra | 4886 |
Tandem Spectra | MS1, MS2, MS3, MS4, MS5, MS6 |
Ionization Methods | NSI |
Analyzers | IT; FT |
Last Modification | 5/10/2016 9:32:50 AM |
InChI | InChI=1S/C23H38O5/c1-2-3-12-15-21-22(28-21)16-13-10-8-6-4-5-7-9-11-14-17-23(26)27-20(18-24)19-25/h4,6-7,9-10,13,20-22,24-25H,2-3,5,8,11-12,14-19H2,1H3/b6-4-,9-7-,13-10- |
InChI Key | LPMVKZXODWQHGJ-ILYOTBPNSA-N |
Canonical SMILES | CCCCCC1C(O1)CC=CCC=CCC=CCCCC(=O)OC(CO)CO |
CAS | 848667561 |
Splash | |
Other Names |
2-14,15-EG; 1,3-Dihydroxypropan-2-yl (5Z,8Z,11Z)-13-(3-pentyloxiran-2-yl)trideca-5,8,11-trienoate; 5,8,11-Tridecatrienoic acid, 13-(3-pentyloxiranyl)-, 2-hydroxy-1-(hydroxymethyl)ethyl ester, (5Z,8Z,11Z)- |