www.chrombox.org

POU-033 / 20:3 n-6 / c8,c11,c14-20:3

Names: Methyl (8Z,11Z,14Z)-icosa-8,11,14-trienoate;  (8Z,11Z,14Z)-Icosa-8,11,14-trienoic acid methyl ester;  (Z,Z,Z)-8,11,14-Icosatrienoic acid methyl ester;  8Z,11Z,14Z-Icosatrienoic acid methyl ester;  cis-8, cis-11, cis-14-Icosatrienoic acid methyl ester;  Methyl (8Z,11Z,14Z)-eicosa-8,11,14-trienoate;  (8Z,11Z,14Z)-Eicosa-8,11,14-trienoic acid methyl ester;  (Z,Z,Z)-8,11,14-Eicosatrienoic acid methyl ester;  8Z,11Z,14Z-Eicosatrienoic acid methyl ester;  cis-8, cis-11, cis-14-Eicosatrienoic acid methyl ester;  Methyl dihomo-gamma-linolenate;  Dihomo-gamma-linolenic acid methyl ester;  Methyl dihomo-γ-linolenate;  Dihomo-γ-linolenic acid methyl ester;  Methyl bishomo-gamma-linolenate;  Bishomo-gamma-linolenic acid methyl ester;  Methyl Bishomo-γ-linolenate;  Bishomo-γ-linolenic acid methyl ester

Formula: C21H36O2

Molar mass: 320.514 Da

Monoisotopic mass: 320.272 Da

SMILES: CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC

InChI Key: QHATYOWJCAQINT-JPFHKJGASA-N

InChI: 1S/C21H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h7-8,10-11,13-14H,3-6,9,12,15-20H2,1-2H3/b8-7-,11-10-,14-13-

Typical retention indexes:
- ECL on BPX70: 21.489
- ECL on Wax: 20.910
- ECL on DB225: 20.743
- ECL on 5% phenyl: 19.487
- ECL on Rxi-1: 19.373
- ECL on SLB-IL61: 20.736
- ECL on SLB-IL82: 21.768
- ECL on SLB-IL100: 22.074
- KI on Wax: 2720
- KI on DB225: 2677
- KI on 5% phenyl: 2277

Non-derivatized:

Names: (8Z,11Z,14Z)-Icosa-8,11,14-trienoic acid;  (Z,Z,Z)-8,11,14-Icosatrienoic acid;  8Z,11Z,14Z-Icosatrienoic acid;  cis-8, cis-11, cis-14-Icosatrienoic acid;  (8Z,11Z,14Z)-Eicosa-8,11,14-trienoic acid;  (Z,Z,Z)-8,11,14-Eicosatrienoic acid;  8Z,11Z,14Z-Eicosatrienoic acid;  cis-8, cis-11, cis-14-Eicosatrienoic acid;  Dihomo-gamma-linolenic acid;  Dihomo-γ-linolenic acid;  Bishomo-gamma-linolenic acid;  Bishomo-γ-linolenic acid;  DGLA

Formula: C20H34O2

Molar mass: 306.487 Da

SMILES: CCCCC\C=C/C/C=C\C\C=C/CCCCCCC(O)=O

InChI Key: HOBAELRKJCKHQD-QNEBEIHSSA-N

InChI: 1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13H,2-5,8,11,14-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-

Lipid Maps code: LMFA01030158



Data are acquired on Agilent 5972, 5973 and 5975 instruments at Nofima, Institute of Marine Research and University of Bergen.
Molecular structures are created in Open Babel.