LMFA05000753 LIPID_MAPS_STRUCTURE_DATABASE 27 27 0 0 0 999 V2000 -0.4307 -0.2488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4307 -0.7460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2986 -0.7460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1667 -0.2488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0349 -0.7460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9031 -0.2488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7712 -0.7460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6394 -0.2488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5075 -0.7460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3757 -1.2434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2439 -1.7408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1120 -2.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9802 -2.7356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8483 -3.2329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7166 -3.7304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2985 -1.7460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7942 -3.6829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2197 -5.0882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1443 -4.5553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9763 -2.1829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2238 -3.4370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0087 -2.4480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7565 -3.4164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -4.1198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4341 -3.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6863 -2.8849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6486 -2.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 1 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 3 0 0 0 0 10 11 1 0 0 0 0 11 12 3 0 0 0 0 12 13 1 0 0 0 0 13 14 3 0 0 0 0 14 15 1 0 0 0 0 3 16 1 0 0 0 21 27 1 0 0 0 26 20 1 0 0 0 20 22 1 0 0 0 22 23 1 0 0 0 23 24 1 0 0 0 24 25 1 0 0 0 25 26 1 0 0 0 26 27 1 1 0 0 22 16 1 1 0 0 23 17 1 6 0 0 24 18 1 1 0 0 25 19 1 6 0 0 M END > LMFA05000753 > > 2-O-beta-D-glucopyranosyloxy-1-hydroxy-6-(E)-tetradecene-8,10,12-triyne > C20H26O7 > 378.17 > Fatty Acyls [FA] > Fatty alcohols [FA05] > > - > > CMWRLNACYUMQJQ-CKPIDSMRSA-N > InChI=1S/C20H26O7/c1-2-3-4-5-6-7-8-9-10-11-12-15(13-21)26-20-19(25)18(24)17(23)16(14-22)27-20/h8-9,15-25H,10-14H2,1H3/b9-8+/t15?,16-,17-,18+,19-,20-/m1/s1 > C(C(O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)CCC/C=C/C#CC#CC#CC)O > - > - > - > - > - > - > 171118586 > - > - > - > - > - > 42337 > 35067120 $$$$