HMDB0055353 RDKit 3D TG(18:3(9Z,12Z,15Z)/O-18:0/20:4(8Z,11Z,14Z,17Z)) 166165 0 0 0 0 0 0 0 0999 V2000 -2.9601 10.3457 0.5348 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2511 10.2498 -0.3033 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7000 8.8591 -0.2642 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8532 8.0437 -1.2776 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5673 8.4734 -2.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5139 7.6037 -3.2035 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5887 6.8068 -4.2448 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7793 6.6862 -5.0314 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4934 5.4190 -5.1337 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2178 4.3208 -4.5304 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1441 4.0241 -3.5856 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2698 2.9766 -4.1738 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0457 1.8496 -3.5712 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5911 1.4688 -2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4353 0.1958 -2.4416 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0258 -0.1888 -1.1001 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9736 -0.4370 -0.0459 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7130 -0.7789 1.2398 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7602 -1.0026 2.3702 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8263 -2.1276 2.1533 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1461 -3.2786 2.5949 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6126 -2.0221 1.4969 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7725 -3.1408 1.3426 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 -3.5823 2.6663 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6234 -2.4460 3.2438 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1123 -1.2471 3.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3852 -0.0690 3.8307 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4799 -0.1076 4.3904 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4424 1.1222 3.7419 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2153 2.1913 4.7859 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2169 3.3192 4.4778 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9373 4.0540 3.2185 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2697 4.9762 3.3552 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5578 5.6834 2.0942 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2177 5.0102 0.9728 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8051 3.7355 0.4427 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7262 2.7387 0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0891 2.9350 0.9872 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4108 1.9464 2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4984 1.1974 2.0187 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5050 1.2564 0.9908 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8679 0.1384 0.1515 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4236 -1.0678 0.0594 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 -1.6563 0.8473 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2453 -2.1535 -0.1535 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5174 -4.7270 2.5776 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2102 -5.7475 3.4091 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6543 -5.6054 4.8051 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0833 -5.7031 5.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1262 -4.8413 4.6113 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3995 -4.7862 3.1653 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7294 -6.1093 2.4998 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8268 -5.7628 0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1355 -6.9701 0.1924 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1593 -6.6732 -1.2918 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7882 -6.1760 -1.7427 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8213 -5.9422 -3.2443 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -5.5010 -3.6431 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3466 -5.3071 -5.1117 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1936 -4.3047 -5.7687 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9411 -2.8818 -5.5596 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9889 -2.2437 -4.2219 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7446 -0.7182 -4.4078 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7835 -0.0765 -3.0675 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2222 10.2649 1.6029 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 9.4824 0.1878 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4983 11.3014 0.2868 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0281 10.8705 0.2297 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0112 10.6876 -1.2672 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9427 8.4297 0.7326 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2011 7.0201 -1.1107 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1443 9.5022 -2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4710 8.5290 -3.2798 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5507 7.6128 -2.6766 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6809 6.2335 -4.5511 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5303 7.5187 -4.8386 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4627 6.9477 -6.1203 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4123 5.4156 -5.8393 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8876 3.4531 -4.7504 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5757 4.8112 -3.1512 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7072 3.5399 -2.6726 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7934 3.1662 -5.1629 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3783 1.1307 -4.1003 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1372 2.1903 -1.7285 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6968 1.1924 -1.6184 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8417 -0.6120 -2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2716 0.4455 -3.1099 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6480 -1.0825 -1.2385 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6773 0.6370 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3244 -1.2921 -0.2939 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4116 0.4943 0.1426 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2916 -1.7121 1.1021 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4075 0.0359 1.5129 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1966 -0.0303 2.4927 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2838 -1.1377 3.3382 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3244 -4.0153 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0785 -2.8500 0.6955 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0763 -3.6872 3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9789 -2.6604 4.2631 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5317 -2.2646 2.6139 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3659 1.5518 2.7151 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5327 0.8451 3.8709 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8048 2.5446 4.8766 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5411 1.7719 5.7574 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2557 3.9382 5.3773 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2107 2.7951 4.3907 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9268 3.4290 2.3339 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8015 4.7712 3.0601 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0243 5.7358 4.1155 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1353 4.4402 3.7966 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1378 6.6302 2.3832 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4465 6.1552 1.7849 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 5.2489 0.9016 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 5.7423 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1745 3.5099 0.0384 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4274 1.7942 0.0566 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 2.9020 0.0899 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2915 3.9086 1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6867 1.8340 2.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6315 0.5114 2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5222 1.5994 1.4873 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3748 2.1683 0.3019 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7349 0.3377 -0.6029 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8860 -1.7880 -0.6965 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8774 -1.0643 1.6121 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7399 -2.6405 1.2391 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6247 -3.0518 -0.6833 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1442 -1.3591 -0.9008 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3643 -2.4364 0.4061 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9107 -5.9436 3.4464 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6252 -6.7093 2.9973 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2139 -4.6523 5.2566 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0522 -6.3914 5.4039 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 -5.5681 6.3027 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3905 -6.8136 5.1105 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0993 -5.0720 5.1644 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 -3.7720 4.9571 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8704 -4.0796 2.5297 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4762 -4.2688 3.1355 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 -6.4245 2.8263 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9585 -6.8695 2.5871 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6135 -4.9819 0.8719 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8273 -5.3580 0.7199 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -7.4177 0.4996 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3658 -7.7521 0.4053 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3593 -7.6092 -1.8362 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8892 -5.9067 -1.5491 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5669 -5.1975 -1.2228 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9665 -6.8589 -1.4512 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1044 -6.8841 -3.7105 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5319 -5.1470 -3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7741 -6.4395 -3.4344 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0233 -4.7097 -3.0413 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2526 -5.0816 -5.3686 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5604 -6.3206 -5.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2932 -4.5223 -6.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2820 -4.5455 -5.4351 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9442 -2.5853 -6.0691 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6686 -2.3080 -6.2577 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9259 -2.3855 -3.6924 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1549 -2.6243 -3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7864 -0.5954 -4.9471 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5398 -0.3019 -5.0555 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8147 0.1399 -2.7383 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1744 0.8686 -3.0512 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3207 -0.7379 -2.3217 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 2 0 37 38 1 0 38 39 1 0 39 40 2 0 40 41 1 0 41 42 1 0 42 43 2 0 43 44 1 0 44 45 1 0 24 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 62 63 1 0 63 64 1 0 1 65 1 0 1 66 1 0 1 67 1 0 2 68 1 0 2 69 1 0 3 70 1 0 4 71 1 0 5 72 1 0 5 73 1 0 6 74 1 0 7 75 1 0 8 76 1 0 8 77 1 0 9 78 1 0 10 79 1 0 11 80 1 0 11 81 1 0 12 82 1 0 13 83 1 0 14 84 1 0 14 85 1 0 15 86 1 0 15 87 1 0 16 88 1 0 16 89 1 0 17 90 1 0 17 91 1 0 18 92 1 0 18 93 1 0 19 94 1 0 19 95 1 0 23 96 1 0 23 97 1 0 24 98 1 1 25 99 1 0 25100 1 0 29101 1 0 29102 1 0 30103 1 0 30104 1 0 31105 1 0 31106 1 0 32107 1 0 32108 1 0 33109 1 0 33110 1 0 34111 1 0 34112 1 0 35113 1 0 35114 1 0 36115 1 0 37116 1 0 38117 1 0 38118 1 0 39119 1 0 40120 1 0 41121 1 0 41122 1 0 42123 1 0 43124 1 0 44125 1 0 44126 1 0 45127 1 0 45128 1 0 45129 1 0 47130 1 0 47131 1 0 48132 1 0 48133 1 0 49134 1 0 49135 1 0 50136 1 0 50137 1 0 51138 1 0 51139 1 0 52140 1 0 52141 1 0 53142 1 0 53143 1 0 54144 1 0 54145 1 0 55146 1 0 55147 1 0 56148 1 0 56149 1 0 57150 1 0 57151 1 0 58152 1 0 58153 1 0 59154 1 0 59155 1 0 60156 1 0 60157 1 0 61158 1 0 61159 1 0 62160 1 0 62161 1 0 63162 1 0 63163 1 0 64164 1 0 64165 1 0 64166 1 0 M END