11764524 -OEChem-04252405572D 170169 0 1 0 0 0 0 0999 V2000 27.1147 3.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -8.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 2.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 1.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 0.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5885 0.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 3.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 -1.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.2487 4.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -6.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1147 5.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -7.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.2487 3.9050 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5981 0.4050 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9282 -7.0950 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 27.1147 6.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -6.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0526 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9186 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -4.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -3.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1865 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7846 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -5.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.3827 3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -6.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.9808 6.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -7.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3205 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6506 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -5.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.9808 7.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.3827 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -6.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4545 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -7.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5167 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -6.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5885 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.8468 8.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -7.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.0367 5.4876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.6381 4.7973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -1.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -0.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 -6.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 -6.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.3268 4.8224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.7253 5.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -0.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -1.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 -7.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 -7.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.7856 4.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -7.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.9027 6.9876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 0 0 8.4607 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6044 -5.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0029 -4.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.1706 3.9876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.7721 3.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2617 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0588 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0463 -2.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6477 -2.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 0.3224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 1.0127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1928 -6.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3957 -6.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 28.1928 6.3224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 28.5913 7.0127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -2.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -2.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -7.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -7.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9220 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7190 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.0492 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.2521 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3142 -5.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9157 -5.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9248 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1278 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3364 -2.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7349 -1.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.7687 8.4876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.3702 7.7973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.9196 2.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0781 -4.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4766 -3.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -6.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -6.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8530 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0560 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 2.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -7.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.5167 1.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -6.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9938 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7908 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9123 -0.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5138 -1.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3933 1.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.6517 3.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 -8.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3889 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5919 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0685 0.3224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4670 1.0127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 29.1568 7.8681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 29.3837 8.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 28.5368 8.9419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -3.5581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -4.6319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 -6.5581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -7.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 -7.6319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16 1 1 1 0 0 0 1155 1 0 0 0 0 17 2 1 1 0 0 0 2156 1 0 0 0 0 18 3 1 6 0 0 0 3157 1 0 0 0 0 4 58 1 0 0 0 0 4 59 1 0 0 0 0 5 60 1 0 0 0 0 5 65 1 0 0 0 0 6 61 1 0 0 0 0 6 66 1 0 0 0 0 7 59 2 0 0 0 0 8 65 2 0 0 0 0 9 66 2 0 0 0 0 10 13 1 0 0 0 0 10 16 1 0 0 0 0 10 67 1 0 0 0 0 10 68 1 0 0 0 0 11 14 1 0 0 0 0 11 17 1 0 0 0 0 11 69 1 0 0 0 0 11 70 1 0 0 0 0 12 15 1 0 0 0 0 12 18 1 0 0 0 0 12 71 1 0 0 0 0 12 72 1 0 0 0 0 13 19 1 0 0 0 0 13 73 1 0 0 0 0 13 74 1 0 0 0 0 14 20 1 0 0 0 0 14 75 1 0 0 0 0 14 76 1 0 0 0 0 15 21 1 0 0 0 0 15 77 1 0 0 0 0 15 78 1 0 0 0 0 16 32 1 0 0 0 0 16 79 1 0 0 0 0 17 35 1 0 0 0 0 17 80 1 0 0 0 0 18 36 1 0 0 0 0 18 81 1 0 0 0 0 19 37 1 0 0 0 0 19 82 1 0 0 0 0 19 83 1 0 0 0 0 20 38 1 0 0 0 0 20 84 1 0 0 0 0 20 85 1 0 0 0 0 21 39 1 0 0 0 0 21 86 1 0 0 0 0 21 87 1 0 0 0 0 22 23 1 0 0 0 0 22 28 1 0 0 0 0 22 88 1 0 0 0 0 22 89 1 0 0 0 0 23 29 1 0 0 0 0 23 90 1 0 0 0 0 23 91 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 24 92 1 0 0 0 0 24 93 1 0 0 0 0 25 27 1 0 0 0 0 25 31 1 0 0 0 0 25 94 1 0 0 0 0 25 95 1 0 0 0 0 26 33 1 0 0 0 0 26 96 1 0 0 0 0 26 97 1 0 0 0 0 27 34 1 0 0 0 0 27 98 1 0 0 0 0 27 99 1 0 0 0 0 28 40 1 0 0 0 0 28100 1 0 0 0 0 28101 1 0 0 0 0 29 41 1 0 0 0 0 29102 1 0 0 0 0 29103 1 0 0 0 0 30 42 1 0 0 0 0 30104 1 0 0 0 0 30105 1 0 0 0 0 31 43 1 0 0 0 0 31106 1 0 0 0 0 31107 1 0 0 0 0 32 47 1 0 0 0 0 32108 1 0 0 0 0 32109 1 0 0 0 0 33 44 1 0 0 0 0 33110 1 0 0 0 0 33111 1 0 0 0 0 34 45 1 0 0 0 0 34112 1 0 0 0 0 34113 1 0 0 0 0 35 51 1 0 0 0 0 35114 1 0 0 0 0 35115 1 0 0 0 0 36 52 1 0 0 0 0 36116 1 0 0 0 0 36117 1 0 0 0 0 37 46 1 0 0 0 0 37118 1 0 0 0 0 37119 1 0 0 0 0 38 48 1 0 0 0 0 38120 1 0 0 0 0 38121 1 0 0 0 0 39 49 1 0 0 0 0 39122 1 0 0 0 0 39123 1 0 0 0 0 40 50 1 0 0 0 0 40124 1 0 0 0 0 40125 1 0 0 0 0 41 53 1 0 0 0 0 41126 1 0 0 0 0 41127 1 0 0 0 0 42 54 1 0 0 0 0 42128 1 0 0 0 0 42129 1 0 0 0 0 43 55 1 0 0 0 0 43130 1 0 0 0 0 43131 1 0 0 0 0 44 56 1 0 0 0 0 44132 1 0 0 0 0 44133 1 0 0 0 0 45 57 1 0 0 0 0 45134 1 0 0 0 0 45135 1 0 0 0 0 46 62 1 0 0 0 0 46136 1 0 0 0 0 46137 1 0 0 0 0 47 53 2 0 0 0 0 47138 1 0 0 0 0 48 63 1 0 0 0 0 48139 1 0 0 0 0 48140 1 0 0 0 0 49 64 1 0 0 0 0 49141 1 0 0 0 0 49142 1 0 0 0 0 50 59 1 0 0 0 0 50143 1 0 0 0 0 50144 1 0 0 0 0 51 54 2 0 0 0 0 51145 1 0 0 0 0 52 55 2 0 0 0 0 52146 1 0 0 0 0 53147 1 0 0 0 0 54148 1 0 0 0 0 55149 1 0 0 0 0 56 65 1 0 0 0 0 56150 1 0 0 0 0 56151 1 0 0 0 0 57 66 1 0 0 0 0 57152 1 0 0 0 0 57153 1 0 0 0 0 58 60 1 0 0 0 0 58 61 1 0 0 0 0 58154 1 0 0 0 0 60158 1 0 0 0 0 60159 1 0 0 0 0 61160 1 0 0 0 0 61161 1 0 0 0 0 62162 1 0 0 0 0 62163 1 0 0 0 0 62164 1 0 0 0 0 63165 1 0 0 0 0 63166 1 0 0 0 0 63167 1 0 0 0 0 64168 1 0 0 0 0 64169 1 0 0 0 0 64170 1 0 0 0 0 M END > 11764524 > 1 > 1110 > 9 > 3 > 53 > AAADcfB8PAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAACBSggAICCAAABgCIACDSCAAAAAAgAAAICAEAAAgBEBIAAQACQAAFwAAKAAOIyKCAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > 2,3-bis[[(Z,12R)-12-hydroxyoctadec-9-enoyl]oxy]propyl (Z,12R)-12-hydroxyoctadec-9-enoate > (Z,12R)-12-hydroxy-9-octadecenoic acid 2,3-bis[(Z,12R)-12-hydroxy-1-oxooctadec-9-enoxy]propyl ester > 2,3-bis[[(Z,12R)-12-hydroxyoctadec-9-enoyl]oxy]propyl (Z,12R)-12-hydroxyoctadec-9-enoate > 2,3-bis[[(Z,12R)-12-hydroxyoctadec-9-enoyl]oxy]propyl (Z,12R)-12-hydroxyoctadec-9-enoate > 2,3-bis[[(Z,12R)-12-oxidanyloctadec-9-enoyl]oxy]propyl (Z,12R)-12-oxidanyloctadec-9-enoate > (Z,12R)-12-hydroxyoctadec-9-enoic acid 2,3-bis[[(Z,12R)-12-hydroxyoctadec-9-enoyl]oxy]propyl ester > InChI=1S/C57H104O9/c1-4-7-10-31-40-51(58)43-34-25-19-13-16-22-28-37-46-55(61)64-49-54(66-57(63)48-39-30-24-18-15-21-27-36-45-53(60)42-33-12-9-6-3)50-65-56(62)47-38-29-23-17-14-20-26-35-44-52(59)41-32-11-8-5-2/h25-27,34-36,51-54,58-60H,4-24,28-33,37-50H2,1-3H3/b34-25-,35-26-,36-27-/t51-,52-,53-/m1/s1 > ZEMPKEQAKRGZGQ-VBJOUPRGSA-N > 17.8 > 932.76803489 > C57H104O9 > 933.4 > CCCCCCC(CC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCC(CCCCCC)O)OC(=O)CCCCCCCC=CCC(CCCCCC)O)O > CCCCCC[C@@H](O)C/C=C\CCCCCCCC(=O)OCC(OC(=O)CCCCCCC/C=C\C[C@H](O)CCCCCC)COC(=O)CCCCCCC/C=C\C[C@H](O)CCCCCC > 140 > 932.76803489 > 0 > 66 > 3 > 0 > 3 > 0 > 0 > 1 > -1 > 1 5 255 > 16 1 5 17 2 5 18 3 6 $$$$