HMDB0289565 RDKit 3D PC(P-18:0/20:4(6Z,8E,10E,14Z)-2OH(5S,12R)) 141140 0 0 0 0 0 0 0 0999 V2000 -3.7165 -2.1419 -2.5517 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 -0.8395 -3.1009 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6755 0.0568 -1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1174 1.3212 -2.5297 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 1.1523 -3.4438 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4093 2.4454 -3.8866 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3435 2.7701 -5.1409 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7412 2.0098 -6.3045 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4296 1.7504 -7.2350 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0704 1.0438 -8.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4078 0.8062 -6.6368 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0947 1.0073 -5.5443 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0399 0.0440 -4.9976 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7027 0.2738 -3.8683 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6012 -0.7185 -3.4115 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2302 -0.4976 -2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1701 0.6337 -1.3906 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7367 0.7665 -1.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6508 1.9266 -1.6982 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6099 3.0132 -0.6892 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3918 3.4600 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6873 2.5966 0.9238 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5075 3.0204 1.2697 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0591 1.4430 1.5077 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4079 0.6276 2.4312 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2374 0.4244 3.6859 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8060 -0.3905 4.6333 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7816 -0.5605 5.4996 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4082 -1.7764 5.8478 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3765 -2.2412 6.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4377 -1.3470 7.3928 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5716 -0.6213 6.4668 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4563 0.2114 7.3094 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4994 1.0503 6.7378 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5973 0.5196 5.9135 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2359 0.0372 4.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4474 -0.5354 3.8305 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5978 0.3643 3.6798 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4328 1.6402 2.9351 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0015 1.5058 1.5145 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9575 2.8432 0.8475 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0096 3.7752 1.5297 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5874 3.2839 1.5486 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7777 4.3592 2.2923 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3409 3.9474 2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0146 -0.6931 1.8191 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0459 -1.4512 1.3386 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5209 -2.9293 0.7201 P 0 0 0 0 0 5 0 0 0 0 0 0 2.5034 -3.4993 1.6904 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8821 -3.9597 0.6588 O 0 0 0 0 0 1 0 0 0 0 0 0 2.9069 -2.8282 -0.8349 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0519 -4.0587 -1.4822 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5232 -4.0969 -2.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1123 -3.8160 -2.9970 N 0 0 0 0 0 4 0 0 0 0 0 0 0.5839 -4.4312 -4.2058 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3676 -4.3931 -1.8914 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8047 -2.4031 -3.0443 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1465 -1.9748 -1.5486 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9136 -2.9085 -2.5108 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4987 -2.5052 -3.2252 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2967 -1.1095 -3.7707 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 -0.3543 -3.6857 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8623 -0.4548 -1.4178 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5445 0.2397 -1.2932 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8597 1.9722 -1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 1.9340 -3.0839 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1239 0.7005 -2.8002 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0942 0.4250 -4.2385 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0735 3.1202 -3.0734 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0832 3.7794 -5.3435 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 1.1077 -6.1315 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 2.6802 -6.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8922 2.6853 -7.5671 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2353 0.1221 -8.0482 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5727 -0.1414 -7.1475 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9871 1.9363 -5.0245 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1865 -0.8963 -5.5608 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4682 1.2256 -3.4188 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7494 -1.6374 -3.9886 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9273 -1.3062 -1.9964 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4847 0.2687 -0.4011 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -0.0827 -1.2952 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7888 1.8498 -1.9192 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3498 2.4206 -2.6558 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1116 3.9641 -1.1243 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3759 2.7933 0.1479 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6577 3.9467 -0.7501 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6914 4.3753 0.5996 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4369 1.0849 2.7545 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2685 0.1446 3.2763 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4613 1.4599 4.1235 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2282 0.2595 5.9446 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0138 -2.5811 5.3507 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -2.9370 7.5054 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7281 -3.0208 6.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9395 -0.5300 7.9848 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2253 -1.8506 8.1516 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1886 -1.4870 6.0456 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0216 -0.1438 5.6755 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9079 -0.4473 8.1493 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7731 0.9088 7.9286 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9581 1.7023 7.5895 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9575 1.9059 6.1634 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 -0.2554 6.4643 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3473 1.3628 5.7742 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7647 0.8487 3.9518 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5108 -0.7718 4.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7646 -1.4038 4.4803 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0796 -0.9855 2.9046 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1225 0.5799 4.6525 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3952 -0.2160 3.1074 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4566 2.1201 2.9047 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8322 2.3906 3.5221 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9903 1.0574 1.4015 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7159 0.8211 1.0113 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6859 2.7015 -0.2362 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9948 3.2779 0.8104 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3281 4.0279 2.5586 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0337 4.7618 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2139 3.2005 0.5085 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 2.3604 2.1361 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9619 5.3066 1.7805 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1523 4.4208 3.3439 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0412 3.8050 3.3808 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 4.7739 1.9294 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 3.0263 1.7154 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4349 -1.3171 2.5508 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -0.4924 0.9683 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5865 -4.8574 -0.8799 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1407 -4.2731 -1.5333 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0765 -3.4712 -3.5909 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6704 -5.1515 -3.2525 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1137 -5.3913 -3.9843 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2061 -3.7642 -4.6275 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3939 -4.6163 -4.9483 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4671 -3.8117 -0.9747 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -5.4499 -1.8157 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6955 -4.4205 -2.1826 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -2.0963 -2.1351 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7461 -1.7981 -3.1472 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -2.1720 -3.9279 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 2 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 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 2 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 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 25 46 1 0 46 47 1 0 47 48 1 0 48 49 2 0 48 50 1 0 48 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 54 56 1 0 54 57 1 0 1 58 1 0 1 59 1 0 1 60 1 0 2 61 1 0 2 62 1 0 3 63 1 0 3 64 1 0 4 65 1 0 4 66 1 0 5 67 1 0 5 68 1 0 6 69 1 0 7 70 1 0 8 71 1 0 8 72 1 0 9 73 1 6 10 74 1 0 11 75 1 0 12 76 1 0 13 77 1 0 14 78 1 0 15 79 1 0 16 80 1 0 17 81 1 1 18 82 1 0 19 83 1 0 19 84 1 0 20 85 1 0 20 86 1 0 21 87 1 0 21 88 1 0 25 89 1 1 26 90 1 0 26 91 1 0 28 92 1 0 29 93 1 0 30 94 1 0 30 95 1 0 31 96 1 0 31 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 45125 1 0 45126 1 0 46127 1 0 46128 1 0 52129 1 0 52130 1 0 53131 1 0 53132 1 0 55133 1 0 55134 1 0 55135 1 0 56136 1 0 56137 1 0 56138 1 0 57139 1 0 57140 1 0 57141 1 0 M CHG 2 50 -1 54 1 M END