131759455 CDK 0427212325 59 58 0 0 0 0 0 0 0 0999 V2000 13.0818 1.6995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9383 1.2870 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6529 0.0495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7963 0.4620 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 2.5246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3674 -1.1880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6542 1.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3688 1.6995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9398 1.6995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9412 3.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6557 4.1746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0832 1.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9412 2.9371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 1.6995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 -3.2506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6557 4.9996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2253 1.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 1.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 -3.6631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0804 1.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 -2.4256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7977 1.6995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 1.6995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 -4.4881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2267 2.5246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3701 5.4121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7949 1.6995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9383 -2.0130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5108 1.6995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2224 1.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7949 -4.9006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5122 1.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2267 1.6995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 1.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9383 -1.1880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3701 6.2371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3674 1.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7963 1.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6529 1.6995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3674 0.4620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 0.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 -6.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 1.6995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7949 -5.7256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -0.7755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 -5.7256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 0.4620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 -5.7256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 1.6995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6529 -0.7755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -1.1880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2224 -6.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 1.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0804 -6.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0847 6.6496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -2.0130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -5.7256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -2.4256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 -6.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 39 1 0 0 0 0 2 49 1 0 0 0 0 3 40 1 0 0 0 0 3 50 1 0 0 0 0 4 38 2 0 0 0 0 5 49 2 0 0 0 0 6 50 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 12 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 16 1 0 0 0 0 12 22 1 0 0 0 0 13 25 1 0 0 0 0 14 18 1 0 0 0 0 14 20 1 0 0 0 0 15 19 1 0 0 0 0 15 21 1 0 0 0 0 16 26 1 0 0 0 0 17 29 1 0 0 0 0 18 23 1 0 0 0 0 19 24 1 0 0 0 0 20 27 1 0 0 0 0 21 28 1 0 0 0 0 22 32 1 0 0 0 0 23 30 1 0 0 0 0 24 31 1 0 0 0 0 25 33 1 0 0 0 0 26 36 1 0 0 0 0 27 34 1 0 0 0 0 28 35 1 0 0 0 0 29 38 1 0 0 0 0 30 43 1 0 0 0 0 31 44 1 0 0 0 0 32 33 2 0 0 0 0 34 49 1 0 0 0 0 35 50 1 0 0 0 0 36 55 1 0 0 0 0 37 39 1 0 0 0 0 37 40 1 0 0 0 0 41 45 1 0 0 0 0 41 47 1 0 0 0 0 42 46 1 0 0 0 0 42 48 1 0 0 0 0 43 53 2 0 0 0 0 44 54 2 0 0 0 0 45 51 1 0 0 0 0 46 52 1 0 0 0 0 47 53 1 0 0 0 0 48 54 1 0 0 0 0 51 56 1 0 0 0 0 52 57 1 0 0 0 0 56 58 1 0 0 0 0 57 59 1 0 0 0 0 M END > CHEBI:170592 > TG(16:1(9Z)/18:1(9Z)/16:1(9Z)) > 2 > 1,3-bis[[(Z)-hexadec-9-enoyl]oxy]propan-2-yl (Z)-octadec-9-enoate > C53H96O6 > 829.345 > 828.72069 > 0 > O(C(COC(=O)CCCCCCC/C=C\CCCCCC)COC(=O)CCCCCCC/C=C\CCCCCC)C(=O)CCCCCCC/C=C\CCCCCCCC > InChI=1S/C53H96O6/c1-4-7-10-13-16-19-22-25-26-29-32-35-38-41-44-47-53(56)59-50(48-57-51(54)45-42-39-36-33-30-27-23-20-17-14-11-8-5-2)49-58-52(55)46-43-40-37-34-31-28-24-21-18-15-12-9-6-3/h20-21,23-26,50H,4-19,22,27-49H2,1-3H3/b23-20-,24-21-,26-25- > WSJUMCLBIMYQBU-ULXWNTFBSA-N $$$$