HMDB0296237 RDKit 3D DG(20:0/0:0/20:3(8Z,11Z,14Z)-O(5,6)) 125125 0 0 0 0 0 0 0 0999 V2000 18.3691 2.8980 1.0103 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1318 2.0458 0.8395 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3070 1.0220 -0.2534 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9648 0.1827 -0.3218 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0865 -0.8156 -1.3765 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0692 -1.7373 -1.7567 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8663 -1.8941 -1.3023 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2276 -1.1254 -0.2378 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9938 -0.4248 -0.7253 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8427 -0.6417 -0.1271 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7255 -1.5633 1.0353 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8294 -2.7050 0.7685 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8008 -3.0084 1.5265 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4002 -2.2754 2.7354 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0501 -1.6694 2.6337 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9669 -2.5357 2.3642 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1871 -1.5219 1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5649 -1.6342 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5062 -1.4843 -0.9731 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6686 -0.2715 -0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7303 -0.2148 0.1758 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2526 -1.3273 0.5813 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3504 0.9356 0.8163 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4389 0.9119 1.8676 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0415 0.7527 1.4020 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1082 0.5748 2.4571 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7489 -0.0679 0.2002 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5496 0.3330 -0.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8378 1.5814 -0.7934 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 2.4428 -0.8199 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1897 2.0012 -1.2993 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0872 2.2387 -0.0889 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4404 2.7271 -0.5036 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2093 1.8627 -1.4161 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5765 0.5060 -0.9988 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4190 0.3136 0.1901 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7470 0.9420 0.2289 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7102 0.5831 -0.8717 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0168 1.3234 -0.6199 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0137 1.0691 -1.6908 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4208 -0.3338 -1.9163 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0510 -1.0537 -0.7821 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3284 -0.3881 -0.2539 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3320 -0.2789 -1.3342 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6163 0.3910 -1.1079 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5909 -0.0578 -0.1274 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2060 -0.0039 1.2934 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.3898 -0.4818 2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.6874 -1.9098 1.7202 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1336 3.9696 0.8022 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2060 2.5876 0.3562 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7259 2.8675 2.0838 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2679 2.6960 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8605 1.5463 1.8075 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1385 0.3396 -0.1001 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3809 1.5374 -1.2115 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2193 0.9478 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8872 -0.2569 0.7149 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0107 -1.4659 -1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5639 -0.3394 -2.3239 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3685 -2.4673 -2.6154 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2798 -2.7183 -1.8021 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8272 -0.5432 0.3978 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8200 -1.9588 0.4697 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0708 0.2465 -1.5609 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9588 -0.1334 -0.4919 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5839 -1.8100 1.6117 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1222 -0.8860 1.7899 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0118 -3.3609 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2329 -3.9098 1.2189 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1234 -1.5420 3.1236 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3643 -3.0555 3.6097 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7720 -1.0501 3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5142 -0.5547 1.6115 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0975 -2.5899 -0.1891 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3737 -0.8488 -0.1133 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 -2.4163 -0.9168 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0222 -1.5379 -1.9684 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3565 0.6186 -0.9121 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0760 -0.1286 -1.8981 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5776 1.8963 2.4142 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7049 0.1586 2.6506 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7575 1.8717 1.1279 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3679 -0.3027 2.3407 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6087 -1.1384 0.4358 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4382 0.1353 -0.6486 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6072 1.2322 -1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0803 2.9755 -1.8146 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5523 2.9709 0.5466 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1802 1.2373 0.4136 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2707 3.7182 -1.0279 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9874 3.0257 0.4191 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0853 2.4728 -1.7821 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5877 1.7589 -2.3599 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9719 -0.0379 -1.8959 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6057 -0.0438 -0.7875 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5117 -0.8039 0.3418 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8556 0.6565 1.0973 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2360 0.6178 1.1932 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6760 2.0455 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9459 -0.4861 -0.9116 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3170 1.0051 -1.8249 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8017 2.4175 -0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3569 0.9884 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5813 1.4393 -2.6696 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8666 1.7649 -1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4691 -0.9086 -2.1532 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0178 -0.4622 -2.8492 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3939 -1.2906 0.0506 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4225 -2.0394 -1.1966 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7056 -1.2044 0.4496 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1536 0.4893 0.3523 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8224 0.1812 -2.2583 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5865 -1.3168 -1.7601 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1475 0.3906 -2.1258 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4642 1.5149 -0.9256 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.5142 0.6130 -0.2401 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.0363 -1.0730 -0.3901 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.0992 1.0798 1.5784 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3724 -0.6110 1.5839 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.2182 0.2062 1.9862 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.0367 -0.4346 3.2115 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.4629 -1.8392 0.9236 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.7850 -2.4070 1.3077 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.0958 -2.4597 2.5732 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 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 25 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 17 15 1 0 1 50 1 0 1 51 1 0 1 52 1 0 2 53 1 0 2 54 1 0 3 55 1 0 3 56 1 0 4 57 1 0 4 58 1 0 5 59 1 0 5 60 1 0 6 61 1 0 7 62 1 0 8 63 1 0 8 64 1 0 9 65 1 0 10 66 1 0 11 67 1 0 11 68 1 0 12 69 1 0 13 70 1 0 14 71 1 0 14 72 1 0 15 73 1 0 17 74 1 0 18 75 1 0 18 76 1 0 19 77 1 0 19 78 1 0 20 79 1 0 20 80 1 0 24 81 1 0 24 82 1 0 25 83 1 6 26 84 1 0 27 85 1 0 27 86 1 0 31 87 1 0 31 88 1 0 32 89 1 0 32 90 1 0 33 91 1 0 33 92 1 0 34 93 1 0 34 94 1 0 35 95 1 0 35 96 1 0 36 97 1 0 36 98 1 0 37 99 1 0 37100 1 0 38101 1 0 38102 1 0 39103 1 0 39104 1 0 40105 1 0 40106 1 0 41107 1 0 41108 1 0 42109 1 0 42110 1 0 43111 1 0 43112 1 0 44113 1 0 44114 1 0 45115 1 0 45116 1 0 46117 1 0 46118 1 0 47119 1 0 47120 1 0 48121 1 0 48122 1 0 49123 1 0 49124 1 0 49125 1 0 M END