CDK 1023151743 60 59 0 0 0 0 0 0 0 0999 V2000 21.4797 -6.3354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5186 -6.8904 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 19.5573 -6.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4796 -5.2256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5961 -6.8904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.7685 -8.0003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.2738 -8.0142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1646 -6.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8791 -6.8904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5935 -6.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3080 -6.8904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0225 -6.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7369 -6.8904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4514 -6.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1659 -6.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8804 -6.8904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5948 -6.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3093 -6.8904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0238 -6.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7382 -6.8904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4527 -6.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1672 -6.8904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8817 -6.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8817 -5.6529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3370 -8.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0514 -8.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7659 -8.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4804 -8.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1949 -8.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9093 -8.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6238 -8.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3383 -8.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0527 -8.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7672 -8.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4817 -8.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1961 -8.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9106 -8.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6251 -8.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3395 -8.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0540 -8.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0540 -9.2378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6190 -4.8131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3335 -5.2256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0480 -4.8131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7624 -5.2256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4769 -4.8131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1914 -5.2256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9059 -4.8131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6204 -4.8131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3349 -5.2256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0494 -4.8131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7638 -5.2256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4783 -4.8131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1928 -5.2256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9073 -4.8131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6217 -5.2256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3362 -4.8131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0507 -5.2256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7651 -4.8131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7651 -3.9881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 4 1 1 0 0 0 0 5 3 1 0 0 0 0 2 6 1 6 0 0 0 2 7 1 1 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 5 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 6 1 0 0 0 0 40 41 2 0 0 0 0 43 42 1 0 0 0 0 44 43 1 0 0 0 0 45 44 1 0 0 0 0 46 45 1 0 0 0 0 47 46 1 0 0 0 0 48 47 1 0 0 0 0 48 49 2 0 0 0 0 50 49 1 0 0 0 0 51 50 1 0 0 0 0 52 51 1 0 0 0 0 53 52 1 0 0 0 0 54 53 1 0 0 0 0 55 54 1 0 0 0 0 56 55 1 0 0 0 0 57 56 1 0 0 0 0 58 57 1 0 0 0 0 59 58 1 0 0 0 0 60 59 2 0 0 0 0 4 59 1 0 0 0 0 M END > CHEBI:89019 > TG(16:1(9Z)/16:0/18:1(11Z))[iso6] > 2 > Triglyceride; Triacylglycerol; Tracylglycerol(50:2); Tracylglycerol(16:1w7/16:0/18:1w7); Tracylglycerol(16:1n7/16:0/18:1n7); Tracylglycerol(16:1/16:0/18:1); TG(50:2); TG(16:1w7/16:0/18:1w7); TG(16:1n7/16:0/18:1n7); TG(16:1/16:0/18:1); TAG(50:2); TAG(16:1w7/16:0/18:1w7); TAG(16:1n7/16:0/18:1n7); TAG(16:1/16:0/18:1); 1-Palmitoleoyl-2-palmitoyl-3-vaccenoyl-glycerol; (2S)-3-[(9Z)-hexadec-9-enoyloxy]-2-(hexadecanoyloxy)propyl (11Z)-octadec-11-enoate > C53H98O6 > 831.344 > 830.73634 > 0 > C([C@@](COC(CCCCCCC/C=C\CCCCCC)=O)(OC(CCCCCCCCCCCCCCC)=O)[H])OC(CCCCCCCCC/C=C\CCCCCC)=O > InChI=1S/C53H98O6/c1-4-7-10-13-16-19-22-25-26-29-31-34-37-40-43-46-52(55)58-49-50(59-53(56)47-44-41-38-35-32-28-24-21-18-15-12-9-6-3)48-57-51(54)45-42-39-36-33-30-27-23-20-17-14-11-8-5-2/h19-20,22-23,50H,4-18,21,24-49H2,1-3H3/b22-19-,23-20-/t50-/m1/s1 > TVENQJOAVIJNCV-WMKGZJNJSA-N > 20671299 $$$$