HMDB0008048 RDKit 3D PC(18:0/20:4(5Z,8Z,11Z,14Z)) 140139 0 0 0 0 0 0 0 0999 V2000 15.0135 -1.7319 0.8437 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3243 -1.9042 -0.4754 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2489 -2.9452 -0.3812 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7835 -4.3151 0.0291 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -5.2081 0.0615 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9825 -5.1528 -1.3004 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8224 -4.6754 -1.6134 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8914 -4.1219 -0.6033 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6010 -2.6814 -0.9151 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4558 -2.1857 -1.1902 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1650 -2.8146 -1.2879 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9496 -4.2252 -1.1233 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2648 -4.8703 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5026 -4.3542 0.8861 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4448 -2.9515 1.1906 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3348 -2.2358 1.1863 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9756 -2.6838 0.8821 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4531 -1.8683 -0.2735 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -0.3926 -0.0193 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4748 -0.0617 1.1192 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 -0.5479 2.2508 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4884 0.9184 0.8832 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3944 1.2720 1.9167 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8026 0.9249 1.4866 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1948 1.6362 0.3861 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7165 1.5871 -0.8671 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7933 0.8196 -1.1868 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3107 2.4895 -1.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7976 2.6073 -1.5291 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3366 1.2245 -1.5786 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8189 1.1193 -1.1706 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5845 1.9612 -2.1135 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0444 1.9424 -1.9916 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6782 2.3775 -0.7628 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4819 1.5679 0.4499 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0074 0.1540 0.1935 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8543 -0.7270 1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4389 -2.0690 1.1295 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7628 -2.7588 -0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3864 -4.1434 -0.2552 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8431 -4.0399 -0.6055 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4511 -5.4052 -0.8753 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3128 -6.2536 0.3558 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0359 -5.5789 1.5052 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3525 2.7560 2.1134 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9075 3.2525 2.4814 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8261 4.9317 2.6760 P 0 0 0 0 0 5 0 0 0 0 0 0 2.1782 5.5392 2.9255 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2307 5.2250 3.9750 O 0 0 0 0 0 1 0 0 0 0 0 0 0.2118 5.5833 1.2446 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2418 6.9925 1.2551 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3256 7.4489 -0.0502 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3713 8.8707 -0.2086 N 0 0 0 0 0 4 0 0 0 0 0 0 0.9557 9.3131 -0.6455 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2982 9.2729 -1.2574 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7084 9.5874 0.9959 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7759 -0.9271 0.7456 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3087 -1.3922 1.6279 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5014 -2.6680 1.1268 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0459 -2.1139 -1.2959 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7969 -0.9412 -0.7272 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5156 -2.6344 0.3778 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7648 -3.0192 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3871 -4.6881 -0.8214 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2952 -4.3054 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9383 -4.8834 0.8915 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9071 -6.2541 0.2707 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6229 -5.5514 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4461 -4.6506 -2.6614 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0600 -4.7373 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4939 -4.0627 0.3774 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4956 -2.0049 -0.8975 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4552 -1.0715 -1.3918 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8430 -2.6099 -2.4257 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3590 -2.1873 -0.8129 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4271 -4.9101 -1.9043 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 -6.0042 -0.3332 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8691 -4.9060 1.8622 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4524 -4.7805 0.8523 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4089 -2.4441 1.4702 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5077 -1.1603 1.4515 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2907 -2.6541 1.7595 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9773 -3.7331 0.5555 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4301 -2.2075 -0.5335 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0881 -2.0446 -1.1648 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0181 0.1059 -0.9458 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3667 0.0081 0.2183 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1416 0.7210 2.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5153 1.0232 2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7856 -0.1919 1.2814 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8074 3.4684 -1.7877 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1928 2.0582 -2.9285 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7649 2.9648 -0.4733 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2964 3.3697 -2.1174 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3083 0.8810 -2.6426 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7002 0.5410 -1.0115 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0805 0.0551 -1.2501 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7886 1.5139 -0.1275 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2268 3.0422 -2.0032 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3451 1.6476 -3.1805 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3556 0.8611 -2.2721 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4212 2.5720 -2.8962 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8013 2.4437 -0.9644 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3994 3.4676 -0.4993 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5504 1.5722 0.9579 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2032 2.0073 1.2773 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0649 0.2660 -0.1154 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4765 -0.3021 -0.6615 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7810 -0.8118 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3947 -0.2712 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3741 -2.6953 2.0471 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5244 -1.8934 0.9001 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7235 -2.2266 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7056 -2.9874 0.2762 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8190 -4.6166 -1.0696 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2811 -4.7089 0.7049 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4125 -3.5555 0.2394 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9958 -3.3589 -1.4734 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9688 -5.8454 -1.7567 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5406 -5.2358 -1.0842 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8666 -7.2191 0.1764 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2645 -6.4744 0.5808 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3152 -4.9729 2.0914 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8014 -4.8935 1.0634 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5090 -6.3473 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1471 3.1130 2.8142 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5871 3.3056 1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2994 7.3392 1.3948 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3231 7.3180 2.1343 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 7.0321 -0.8758 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 7.0480 -0.1485 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9713 9.1600 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1008 10.3976 -0.4571 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7197 8.6702 -0.1888 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2901 8.8084 -1.1724 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8577 9.0970 -2.2465 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4512 10.3683 -1.1086 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4463 9.0402 1.6146 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1447 9.8424 1.6279 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2279 10.5537 0.7339 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 2 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 2 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 2 0 26 28 1 0 28 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 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 23 45 1 0 45 46 1 0 46 47 1 0 47 48 2 0 47 49 1 0 47 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 53 55 1 0 53 56 1 0 1 57 1 0 1 58 1 0 1 59 1 0 2 60 1 0 2 61 1 0 3 62 1 0 3 63 1 0 4 64 1 0 4 65 1 0 5 66 1 0 5 67 1 0 6 68 1 0 7 69 1 0 8 70 1 0 8 71 1 0 9 72 1 0 10 73 1 0 11 74 1 0 11 75 1 0 12 76 1 0 13 77 1 0 14 78 1 0 14 79 1 0 15 80 1 0 16 81 1 0 17 82 1 0 17 83 1 0 18 84 1 0 18 85 1 0 19 86 1 0 19 87 1 0 23 88 1 1 24 89 1 0 24 90 1 0 28 91 1 0 28 92 1 0 29 93 1 0 29 94 1 0 30 95 1 0 30 96 1 0 31 97 1 0 31 98 1 0 32 99 1 0 32100 1 0 33101 1 0 33102 1 0 34103 1 0 34104 1 0 35105 1 0 35106 1 0 36107 1 0 36108 1 0 37109 1 0 37110 1 0 38111 1 0 38112 1 0 39113 1 0 39114 1 0 40115 1 0 40116 1 0 41117 1 0 41118 1 0 42119 1 0 42120 1 0 43121 1 0 43122 1 0 44123 1 0 44124 1 0 44125 1 0 45126 1 0 45127 1 0 51128 1 0 51129 1 0 52130 1 0 52131 1 0 54132 1 0 54133 1 0 54134 1 0 55135 1 0 55136 1 0 55137 1 0 56138 1 0 56139 1 0 56140 1 0 M CHG 2 49 -1 53 1 M END