HMDB0284614 RDKit 3D PE(24:1(15Z)/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)) 151150 0 0 0 0 0 0 0 0999 V2000 6.0295 -6.8070 2.8806 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0813 -5.6908 2.8176 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3803 -5.3717 1.4304 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1848 -4.1947 0.8988 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6407 -3.0011 1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6855 -1.8978 1.5148 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8243 -2.3474 2.1691 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2203 -0.6546 2.1748 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3718 0.2027 1.6054 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9401 1.4048 2.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1087 2.2296 1.7098 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5284 2.0540 0.3701 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9179 3.2565 -0.4189 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0372 4.0821 -0.9183 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6317 3.8742 -0.7299 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7158 4.7168 -1.2373 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2575 4.3865 -0.9648 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1293 3.0748 -1.3455 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5994 5.3580 -1.6144 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9259 5.2212 -1.7159 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6473 4.0764 -1.1778 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6899 4.4364 -0.1604 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2099 5.1614 1.0388 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1808 4.4925 1.8226 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8113 3.3321 1.4905 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5825 5.0600 2.8986 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5807 4.4940 3.6392 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0205 4.2010 5.0386 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0071 3.2352 5.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8754 1.9044 4.8626 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8272 1.5490 4.2784 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9568 0.9015 5.1663 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5718 -0.4614 4.7469 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4815 -0.7474 3.2703 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8716 -0.6424 2.7014 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1043 -0.9876 1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4484 -0.1516 0.2627 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8185 -0.7090 -1.1022 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3918 0.0026 -2.2947 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9835 0.2549 -2.5964 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0716 -0.9437 -2.7321 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3099 -0.4726 -3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2874 -1.5857 -3.2992 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5786 -2.3084 -1.9864 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5734 -3.3650 -2.2456 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4262 -4.6334 -2.0106 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2142 -5.2211 -1.4346 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6493 -6.2830 -2.3949 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5653 -6.9306 -1.8316 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7407 -6.0611 -1.5821 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3113 -5.4084 -2.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7552 -6.4462 -3.8324 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3298 -5.7272 -5.0287 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3235 -4.8231 -5.6705 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7093 5.2909 3.6639 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 5.4912 2.4419 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7056 6.3970 2.5156 P 0 0 0 0 0 5 0 0 0 0 0 0 3.8351 5.5807 1.9351 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1133 6.8622 4.0657 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5603 7.7952 1.5291 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2572 7.8748 1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0388 9.0565 0.1484 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2821 10.2970 0.8447 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0859 -6.4536 2.3977 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4696 -7.6774 2.3623 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -7.0140 3.9525 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9860 -6.1493 3.3102 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7127 -4.8870 3.4428 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7967 -6.1781 0.8116 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4658 -4.1064 -0.1804 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7487 -2.5902 1.0428 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3720 -3.2286 2.6042 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9660 -1.7085 0.4511 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6197 -3.1260 2.7524 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5727 -0.4170 3.1641 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0331 -0.0522 0.6367 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3366 1.6299 3.3082 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8262 3.1187 2.2938 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8906 1.1540 -0.1782 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4418 1.9425 0.5117 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9762 3.4841 -0.6032 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4188 4.9490 -1.4954 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2044 3.0558 -0.1828 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0376 5.5622 -1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2053 4.4277 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8953 2.7318 -1.8569 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1784 6.2655 -2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 6.0008 -2.2198 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0329 3.2119 -0.8627 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2501 3.6565 -2.0504 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1883 3.4837 0.1771 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5039 4.9931 -0.6904 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0667 5.3740 1.7358 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8925 6.1914 0.6945 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2649 3.4832 3.2162 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4119 5.1334 5.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1584 3.8925 5.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9321 1.2085 4.7658 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0340 0.8836 6.2919 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 -0.6989 5.1951 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2363 -1.2250 5.2545 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1481 -1.8080 3.1768 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7646 -0.0379 2.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5007 -1.3274 3.3534 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2639 0.3813 2.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9312 -2.0910 1.1106 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2212 -0.8968 1.1166 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8169 0.8852 0.3123 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3509 -0.1509 0.3824 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4794 -1.7781 -1.0815 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9413 -0.7941 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9067 1.0263 -2.3079 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8269 -0.5407 -3.2025 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9429 0.7563 -3.6163 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5133 1.0254 -1.9198 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4293 -1.7010 -3.4237 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9371 -1.3611 -1.6965 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2361 0.0340 -4.1506 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7186 0.2667 -2.4301 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2166 -1.2365 -3.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8299 -2.3398 -4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6758 -2.6032 -1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0845 -1.5470 -1.3124 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5454 -3.0575 -2.6875 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 -5.3456 -2.2448 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4401 -4.5373 -1.1054 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5545 -5.7656 -0.4948 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5445 -5.9157 -3.4141 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4501 -7.0808 -2.4191 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2527 -7.3580 -0.8289 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -7.8245 -2.4189 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5488 -6.6329 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4738 -5.1975 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6455 -4.6560 -3.2671 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2408 -4.8704 -2.4969 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9223 -7.1222 -4.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5353 -7.0848 -3.3851 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7398 -6.4631 -5.7809 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 -5.1090 -4.7497 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4566 -4.8225 -6.7826 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -3.7456 -5.3824 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2938 -5.1036 -5.4085 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4337 4.6622 4.2633 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 6.2491 4.1903 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7253 6.1765 4.6991 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0695 6.9510 0.4576 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5079 7.9077 1.8557 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0269 9.0429 -0.1594 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6142 8.9922 -0.8054 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0012 10.1131 1.5648 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6352 10.9667 0.1212 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 1 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 2 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 27 55 1 0 55 56 1 0 56 57 1 0 57 58 2 0 57 59 1 0 57 60 1 0 60 61 1 0 61 62 1 0 62 63 1 0 1 64 1 0 1 65 1 0 1 66 1 0 2 67 1 0 2 68 1 0 3 69 1 0 4 70 1 0 5 71 1 0 5 72 1 0 6 73 1 6 7 74 1 0 8 75 1 0 9 76 1 0 10 77 1 0 11 78 1 0 12 79 1 0 12 80 1 0 13 81 1 0 14 82 1 0 15 83 1 0 16 84 1 0 17 85 1 1 18 86 1 0 19 87 1 0 20 88 1 0 21 89 1 0 21 90 1 0 22 91 1 0 22 92 1 0 23 93 1 0 23 94 1 0 27 95 1 6 28 96 1 0 28 97 1 0 32 98 1 0 32 99 1 0 33100 1 0 33101 1 0 34102 1 0 34103 1 0 35104 1 0 35105 1 0 36106 1 0 36107 1 0 37108 1 0 37109 1 0 38110 1 0 38111 1 0 39112 1 0 39113 1 0 40114 1 0 40115 1 0 41116 1 0 41117 1 0 42118 1 0 42119 1 0 43120 1 0 43121 1 0 44122 1 0 44123 1 0 45124 1 0 46125 1 0 47126 1 0 47127 1 0 48128 1 0 48129 1 0 49130 1 0 49131 1 0 50132 1 0 50133 1 0 51134 1 0 51135 1 0 52136 1 0 52137 1 0 53138 1 0 53139 1 0 54140 1 0 54141 1 0 54142 1 0 55143 1 0 55144 1 0 59145 1 0 61146 1 0 61147 1 0 62148 1 0 62149 1 0 63150 1 0 63151 1 0 M END