22037 -OEChem-05042415192D 147144 0 1 0 0 0 0 0999 V2000 23.6506 0.2500 0.0000 Ca 0 2 0 0 0 0 0 0 0 0 0 0 17.5885 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 29.7128 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 30.5788 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.1865 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.1147 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.3205 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.9808 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.7846 -0.2500 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 24.5167 -0.2500 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 21.9186 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.3827 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 38.3731 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 37.5070 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 39.2391 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.6410 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 40.1051 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.7750 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 40.9711 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.9090 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 41.8372 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.0429 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 42.7032 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.1769 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 43.5692 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.3109 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 44.4352 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.4449 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 45.3013 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.5788 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4545 0.2500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 28.8468 0.2500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 18.4545 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.8468 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3205 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.9808 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0526 -0.2500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 26.2487 -0.2500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 21.0526 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.2487 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9186 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.3827 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3267 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 37.9745 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 38.7716 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1928 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3957 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 37.9056 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 37.1085 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 39.6376 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 38.8406 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2617 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0588 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 36.2425 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 37.0395 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 39.7066 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 40.5036 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9248 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1278 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 36.1735 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 35.3765 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 41.3697 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 40.5726 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9938 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7908 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 34.5104 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 35.3075 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 41.4386 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 42.2357 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6569 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8598 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 34.4415 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 33.6444 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 43.1017 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 42.3047 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7258 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5229 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 32.7784 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 33.5754 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 43.1707 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 43.9677 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3889 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5919 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 32.7094 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 31.9124 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 44.8338 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 44.0367 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4579 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2549 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 31.0463 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 31.8434 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 44.9913 -0.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 45.8382 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 45.6113 0.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4545 -0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 29.3837 0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0745 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4545 1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8345 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 29.4668 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 28.8468 1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 28.2268 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.0526 0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.7856 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4326 -1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.0526 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.6726 -1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.6287 -1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.2487 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.8687 -1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 48 1 0 0 0 0 2 50 1 0 0 0 0 3 49 1 0 0 0 0 3 51 1 0 0 0 0 4 48 2 0 0 0 0 5 49 2 0 0 0 0 6 54 1 0 0 0 0 6 56 1 0 0 0 0 7 55 1 0 0 0 0 7 57 1 0 0 0 0 8 54 2 0 0 0 0 9 55 2 0 0 0 0 10 60 1 0 0 0 0 11 61 1 0 0 0 0 12 60 2 0 0 0 0 13 61 2 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 14 62 1 0 0 0 0 14 63 1 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 15 64 1 0 0 0 0 15 65 1 0 0 0 0 16 20 1 0 0 0 0 16 66 1 0 0 0 0 16 67 1 0 0 0 0 17 21 1 0 0 0 0 17 68 1 0 0 0 0 17 69 1 0 0 0 0 18 22 1 0 0 0 0 18 70 1 0 0 0 0 18 71 1 0 0 0 0 19 23 1 0 0 0 0 19 72 1 0 0 0 0 19 73 1 0 0 0 0 20 24 1 0 0 0 0 20 74 1 0 0 0 0 20 75 1 0 0 0 0 21 25 1 0 0 0 0 21 76 1 0 0 0 0 21 77 1 0 0 0 0 22 26 1 0 0 0 0 22 78 1 0 0 0 0 22 79 1 0 0 0 0 23 27 1 0 0 0 0 23 80 1 0 0 0 0 23 81 1 0 0 0 0 24 28 1 0 0 0 0 24 82 1 0 0 0 0 24 83 1 0 0 0 0 25 29 1 0 0 0 0 25 84 1 0 0 0 0 25 85 1 0 0 0 0 26 30 1 0 0 0 0 26 86 1 0 0 0 0 26 87 1 0 0 0 0 27 31 1 0 0 0 0 27 88 1 0 0 0 0 27 89 1 0 0 0 0 28 32 1 0 0 0 0 28 90 1 0 0 0 0 28 91 1 0 0 0 0 29 33 1 0 0 0 0 29 92 1 0 0 0 0 29 93 1 0 0 0 0 30 34 1 0 0 0 0 30 94 1 0 0 0 0 30 95 1 0 0 0 0 31 35 1 0 0 0 0 31 96 1 0 0 0 0 31 97 1 0 0 0 0 32 36 1 0 0 0 0 32 98 1 0 0 0 0 32 99 1 0 0 0 0 33 37 1 0 0 0 0 33100 1 0 0 0 0 33101 1 0 0 0 0 34 38 1 0 0 0 0 34102 1 0 0 0 0 34103 1 0 0 0 0 35 39 1 0 0 0 0 35104 1 0 0 0 0 35105 1 0 0 0 0 36 40 1 0 0 0 0 36106 1 0 0 0 0 36107 1 0 0 0 0 37 41 1 0 0 0 0 37108 1 0 0 0 0 37109 1 0 0 0 0 38 42 1 0 0 0 0 38110 1 0 0 0 0 38111 1 0 0 0 0 39 43 1 0 0 0 0 39112 1 0 0 0 0 39113 1 0 0 0 0 40 44 1 0 0 0 0 40114 1 0 0 0 0 40115 1 0 0 0 0 41 45 1 0 0 0 0 41116 1 0 0 0 0 41117 1 0 0 0 0 42 46 1 0 0 0 0 42118 1 0 0 0 0 42119 1 0 0 0 0 43 47 1 0 0 0 0 43120 1 0 0 0 0 43121 1 0 0 0 0 44 48 1 0 0 0 0 44122 1 0 0 0 0 44123 1 0 0 0 0 45 49 1 0 0 0 0 45124 1 0 0 0 0 45125 1 0 0 0 0 46126 1 0 0 0 0 46127 1 0 0 0 0 46128 1 0 0 0 0 47129 1 0 0 0 0 47130 1 0 0 0 0 47131 1 0 0 0 0 50 52 1 0 0 0 0 50 54 1 0 0 0 0 50132 1 0 0 0 0 51 53 1 0 0 0 0 51 55 1 0 0 0 0 51133 1 0 0 0 0 52134 1 0 0 0 0 52135 1 0 0 0 0 52136 1 0 0 0 0 53137 1 0 0 0 0 53138 1 0 0 0 0 53139 1 0 0 0 0 56 58 1 0 0 0 0 56 60 1 0 0 0 0 56140 1 0 0 0 0 57 59 1 0 0 0 0 57 61 1 0 0 0 0 57141 1 0 0 0 0 58142 1 0 0 0 0 58143 1 0 0 0 0 58144 1 0 0 0 0 59145 1 0 0 0 0 59146 1 0 0 0 0 59147 1 0 0 0 0 M CHG 3 1 2 10 -1 11 -1 M END > 22037 > 1 > 457 > 12 > 0 > 42 > AAADcfB8PAAAAAgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAAAAAACBSggAICCAAABAAIAACQCAIAAAAAAAAAAAFAAAABABIAAAQCAAAEAAACAAGIyKCAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > calcium;2-(2-octadecanoyloxypropanoyloxy)propanoate > calcium;2-[1-oxo-2-(1-oxooctadecoxy)propoxy]propanoate > calcium;2-(2-octadecanoyloxypropanoyloxy)propanoate > calcium;2-(2-octadecanoyloxypropanoyloxy)propanoate > calcium;2-(2-octadecanoyloxypropanoyloxy)propanoate > calcium;2-(2-stearoyloxypropanoyloxy)propionate > InChI=1S/2C24H44O6.Ca/c2*1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)29-21(3)24(28)30-20(2)23(26)27;/h2*20-21H,4-19H2,1-3H3,(H,26,27);/q;;+2/p-2 > OEUVSBXAMBLPES-UHFFFAOYSA-L > 894.5745190 > C48H86CaO12 > 895.3 > CCCCCCCCCCCCCCCCCC(=O)OC(C)C(=O)OC(C)C(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)OC(C)C(=O)OC(C)C(=O)[O-].[Ca+2] > CCCCCCCCCCCCCCCCCC(=O)OC(C)C(=O)OC(C)C(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)OC(C)C(=O)OC(C)C(=O)[O-].[Ca+2] > 186 > 894.5745190 > 0 > 61 > 0 > 4 > 0 > 0 > 0 > 3 > -1 > 1 5 255 > 50 52 3 51 53 3 56 58 3 57 59 3 $$$$