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OXP-716 / Ox 18:3 n-3 / Methylated 13(S)-HPOT |
Typical retention indexes:
- ECL on BPX70: 23.093
- ECL on Wax: 21.262
- ECL on DB225: 21.186
- ECL on 5% phenyl: 18.425
- KI on Wax: 2756
- KI on DB225: 2723
- KI on 5% phenyl: 2170
Names: (9Z,11E,13S,15Z)-13-hydroperoxyoctadeca-9,11,15-trienoic acid; 13(S)-Hydroperoxy-9(Z),11(E),15(Z)-octadecatrienoic acid; 13S-hydroperoxy-9Z,11E,15Z-octadecatrienoic acid; 13(S)-Hydroperoxylinolenic acid; 13S-HpOTrE; 13(S)-HPOT
Formula: C18H30O4
Molar mass: 310.433 Da
SMILES: CC\C=C/C[C@H](OO)\C=C\C=C/CCCCCCCC(O)=O
InChI Key: UYQGVDXDXBAABN-FQSPHKRJSA-N
InChI: 1S/C18H30O4/c1-2-3-11-14-17(22-21)15-12-9-7-5-4-6-8-10-13-16-18(19)20/h3,7,9,11-12,15,17,21H,2,4-6,8,10,13-14,16H2,1H3,(H,19,20)/b9-7-,11-3-,15-12+/t17-/m0/s1
Lipid Maps code: LMFA02000052
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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. |