Systematic / IUPAC Name: 1,3-Dihydroxy-2-propanyl (9Z,12Z)-9,12-octadecadienoate
ID: Reference4739
Other Names:
β-Monolinolein;
2-(9Z,12Z-Octadecadienoyl)-glycerol;
2-Glyceryl 9,12-octadecadienoate;
2-LG;
2-Linoleoylglycerol
; more
Formula: C21H38O4
Class: Endogenous Metabolites
2-Linoleoyl 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 | 416 |
Tandem Spectra | MS1, MS2, MS3 |
Ionization Methods | NSI |
Analyzers | IT; FT |
Last Modification | 5/9/2016 8:52:16 AM |
InChI | InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-20(18-22)19-23/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9- |
InChI Key | IEPGNWMPIFDNSD-HZJYTTRNSA-N |
Canonical SMILES | CCCCCC=CCC=CCCCCCCCC(=O)OC(CO)CO |
CAS | 3443821 |
Splash | |
Other Names |
β-Monolinolein; 2-(9Z,12Z-Octadecadienoyl)-glycerol; 2-Glyceryl 9,12-octadecadienoate; 2-LG; 2-Linoleoylglycerol; 2-Monolinolein; 2-Monolinoleoylglycerol; Glyceryl 2-linoleate; Linolein, 2-mono-; (9Z,12Z)-9,12-Octadecadienoic acid 2-hydroxy-1-(hydroxymethyl)ethyl ester; 1,3-Dihydroxypropan-2-yl (9Z,12Z)-octadeca-9,12-dienoate; 9,12-Octadecadienoic acid (Z,Z)-, 2-hydroxy-1-(hydroxymethyl)ethyl ester |
ChEBI | CHEBI:75457 |
PubChem | 5365676 |
HMDb | HMDB11538 |
ChemSpider | 4517636 |