HMDB0288676 RDKit 3D PC(24:0/22:6(4Z,7Z,10Z,13E,15E,19Z)-OH(17)) 161160 0 0 0 0 0 0 0 0999 V2000 1.2906 -5.0255 2.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7212 -3.6858 3.4688 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6768 -3.1284 4.3291 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0971 -1.9820 4.1102 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3696 -1.0845 3.0185 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 0.2924 3.4794 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 0.0755 4.1908 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2225 0.9243 4.2987 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1415 1.6596 3.6871 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 2.3173 4.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0949 3.0224 3.6937 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2619 3.7322 4.3776 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5073 3.1444 3.8024 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4433 3.7781 3.1768 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4521 5.2457 2.9169 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4123 5.4084 1.4442 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5289 6.1315 0.7669 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4747 6.8813 1.3849 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0833 6.5964 1.1276 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5563 5.6590 0.4359 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1992 4.5863 -0.2968 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8583 4.6968 -1.7825 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4238 3.4970 -2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6356 3.4049 -2.7654 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5688 2.4863 -2.8651 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9464 1.2900 -3.5205 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6750 0.1439 -2.5926 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8259 -1.1559 -3.0056 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0509 -1.8940 -3.8593 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0356 -1.3511 -4.3663 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3259 -3.3098 -4.2282 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2231 -3.9431 -5.0115 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1024 -3.9961 -4.3145 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0981 -4.6669 -5.2222 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4864 -4.7420 -4.6439 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 -3.3618 -4.3668 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4561 -3.4019 -3.8168 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8917 -1.9647 -3.6166 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3058 -1.8725 -3.1172 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8191 -0.4986 -2.9228 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1469 0.3607 -1.9155 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2415 -0.1960 -0.5094 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5893 0.7386 0.4976 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7276 0.1878 1.9028 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1284 1.1089 2.9473 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3721 0.4369 4.2806 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8809 1.2078 5.4621 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2041 0.3958 6.6912 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7830 1.0206 7.9737 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2889 1.2487 8.0425 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8854 1.8896 9.3467 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2565 1.0456 10.5395 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6141 -0.3035 10.5282 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3903 1.1772 -4.8949 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8235 2.2698 -5.6979 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1326 1.9909 -7.2430 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.5371 3.0923 -8.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4627 1.9118 -7.0243 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.6895 0.4924 -7.7286 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2792 0.0732 -8.9641 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9383 -1.2977 -9.1833 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3725 -1.2224 -9.1378 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.8832 -1.0941 -7.7832 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8713 -2.5003 -9.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9349 -0.1728 -9.9374 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 -5.3829 2.2503 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1354 -5.7982 3.6688 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3993 -4.9394 2.2355 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0647 -3.0840 2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6091 -3.9387 4.1162 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3943 -3.7540 5.2065 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6808 -1.6761 4.8404 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5479 -0.9703 2.3839 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1445 -1.4585 2.3414 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0886 0.8664 2.5677 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7996 0.1895 5.1538 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3049 0.8264 5.3677 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0654 1.7655 2.6147 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3908 2.2776 5.4595 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0591 3.1541 2.6266 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1908 3.4711 5.4484 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1550 4.7998 4.2586 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5879 2.0434 3.9548 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2933 3.1572 2.8174 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4862 5.5779 3.2638 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7114 5.7865 3.4807 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1653 4.9029 0.8036 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6179 6.1808 -0.3541 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5922 6.9945 2.5064 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6450 7.9884 1.0259 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3082 7.3031 1.6035 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4173 5.6281 0.3613 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2362 4.3528 -0.1128 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6549 3.6107 0.0316 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3408 5.5879 -2.1705 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7688 4.7747 -1.8884 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0832 1.3290 -3.6704 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1881 0.3299 -1.5955 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5751 0.2868 -2.2813 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5493 -3.8545 -3.3127 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -3.2946 -4.8649 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0523 -3.4616 -5.9946 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5265 -4.9846 -5.2299 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4683 -2.9796 -4.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0117 -4.5731 -3.3613 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1149 -4.1522 -6.1918 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7691 -5.7138 -5.4167 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5378 -5.3483 -3.7382 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1362 -5.2096 -5.4101 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4176 -2.8885 -3.5912 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0972 -2.7619 -5.3098 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5276 -4.0044 -2.8892 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0922 -3.8972 -4.5762 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2365 -1.4314 -2.9009 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7795 -1.4605 -4.5964 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4559 -2.5019 -2.2122 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9502 -2.3538 -3.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7064 0.0408 -3.9152 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9291 -0.5426 -2.7871 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1043 0.5192 -2.2296 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6377 1.3400 -1.9005 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6653 -1.1443 -0.4975 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2944 -0.3428 -0.2202 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1314 1.6965 0.4457 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 0.9273 0.2353 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7890 0.0417 2.1735 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2423 -0.8083 1.9087 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6535 2.0729 2.9704 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0570 1.3108 2.7746 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4541 0.2465 4.3628 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8813 -0.5601 4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8737 1.6021 5.4082 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5451 2.1265 5.5362 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2954 0.1955 6.6613 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7189 -0.6087 6.6218 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3377 1.9665 8.2026 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0507 0.3221 8.7973 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0507 1.9777 7.2333 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 0.2846 7.8679 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3917 2.8718 9.4247 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7942 2.0749 9.3959 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9673 1.5418 11.4932 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3576 0.8950 10.6191 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8399 -0.8987 9.6357 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5124 -0.2179 10.7103 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0105 -0.8712 11.4045 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3037 1.2124 -4.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8320 0.2598 -5.3657 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1727 -0.1564 -8.9343 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4279 0.7582 -9.7936 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6535 -1.6070 -10.2088 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6014 -2.0116 -8.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9563 -0.0088 -7.4789 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2636 -1.6792 -7.0633 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9225 -1.4807 -7.6868 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9478 -2.3627 -9.8652 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6963 -3.2865 -8.9107 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2788 -2.7019 -10.5831 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0102 0.0173 -9.6557 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4468 0.8125 -9.8158 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9678 -0.5066 -10.9944 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 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 2 0 29 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 45 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 26 54 1 0 54 55 1 0 55 56 1 0 56 57 2 0 56 58 1 0 56 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 62 63 1 0 62 64 1 0 62 65 1 0 1 66 1 0 1 67 1 0 1 68 1 0 2 69 1 0 2 70 1 0 3 71 1 0 4 72 1 0 5 73 1 0 5 74 1 0 6 75 1 0 7 76 1 0 8 77 1 0 9 78 1 0 10 79 1 0 11 80 1 0 12 81 1 0 12 82 1 0 13 83 1 0 14 84 1 0 15 85 1 0 15 86 1 0 16 87 1 0 17 88 1 0 18 89 1 0 18 90 1 0 19 91 1 0 20 92 1 0 21 93 1 0 21 94 1 0 22 95 1 0 22 96 1 0 26 97 1 6 27 98 1 0 27 99 1 0 31100 1 0 31101 1 0 32102 1 0 32103 1 0 33104 1 0 33105 1 0 34106 1 0 34107 1 0 35108 1 0 35109 1 0 36110 1 0 36111 1 0 37112 1 0 37113 1 0 38114 1 0 38115 1 0 39116 1 0 39117 1 0 40118 1 0 40119 1 0 41120 1 0 41121 1 0 42122 1 0 42123 1 0 43124 1 0 43125 1 0 44126 1 0 44127 1 0 45128 1 0 45129 1 0 46130 1 0 46131 1 0 47132 1 0 47133 1 0 48134 1 0 48135 1 0 49136 1 0 49137 1 0 50138 1 0 50139 1 0 51140 1 0 51141 1 0 52142 1 0 52143 1 0 53144 1 0 53145 1 0 53146 1 0 54147 1 0 54148 1 0 60149 1 0 60150 1 0 61151 1 0 61152 1 0 63153 1 0 63154 1 0 63155 1 0 64156 1 0 64157 1 0 64158 1 0 65159 1 0 65160 1 0 65161 1 0 M CHG 2 58 -1 62 1 M END