HMDB0296866 RDKit 3D DG(20:4(5Z,8Z,11Z,14Z)-OH(20)/0:0/2:0) 71 70 0 0 0 0 0 0 0 0999 V2000 9.6879 -2.3540 1.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4017 -1.5462 1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7918 -1.3647 0.8457 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9414 -1.0509 3.0819 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8190 -0.3240 3.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5005 -0.9918 3.2233 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4371 -2.1521 4.0092 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9767 -1.2729 1.8598 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0670 -0.0913 1.0797 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6411 -0.0850 -0.2657 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1940 -1.1621 -0.7039 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7784 1.1842 -0.9754 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2849 1.1607 -2.3911 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8271 0.8511 -2.5519 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 1.8191 -1.8735 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0737 2.5690 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7869 2.5815 -3.8889 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4558 2.2418 -4.5033 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 1.8135 -3.9924 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7537 1.5653 -2.5539 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8032 2.4393 -2.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8741 1.9791 -1.4388 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1717 0.5393 -1.2803 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3033 0.3156 0.1752 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3778 -0.1475 0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5641 -0.4917 -0.0482 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8955 -1.9248 0.2083 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5165 -2.4432 1.4002 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2033 -2.1755 2.7903 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7252 -0.9295 3.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4675 0.2943 2.9714 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4530 -3.2474 1.2007 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4961 -1.7591 1.4014 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8748 -2.7200 2.8595 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8780 0.1017 4.4244 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8591 0.6290 2.7523 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7214 -0.3158 3.7742 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3115 -2.5884 3.9278 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3704 -2.1500 1.3574 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8311 -1.4107 1.9748 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8884 1.3818 -1.0495 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3673 2.0505 -0.4003 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8486 0.3441 -2.9146 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5463 2.1596 -2.8339 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6817 -0.1725 -2.0757 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5375 0.6804 -3.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0749 1.9213 -0.7794 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5409 3.2749 -1.7917 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9723 3.6984 -4.2277 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 2.1161 -4.5099 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 2.3666 -5.6458 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4306 1.6085 -4.6536 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1067 0.4686 -2.4562 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8519 1.5479 -1.9532 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 3.5453 -2.0924 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6219 2.6769 -1.0471 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4054 -0.1491 -1.6528 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1182 0.3972 -1.8626 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4439 0.5591 0.7832 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4011 -0.3289 1.8317 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5269 -0.3622 -1.1244 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4262 0.1790 0.3003 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5480 -2.3165 -0.6769 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9556 -2.5627 0.0088 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4772 -3.6175 1.2706 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6940 -2.3641 1.3025 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0965 -2.3020 3.0162 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6386 -3.0301 3.4247 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8574 -1.1117 3.5476 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4248 -0.9274 4.5385 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2484 0.8829 3.0633 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 1 32 1 0 1 33 1 0 1 34 1 0 5 35 1 0 5 36 1 0 6 37 1 1 7 38 1 0 8 39 1 0 8 40 1 0 12 41 1 0 12 42 1 0 13 43 1 0 13 44 1 0 14 45 1 0 14 46 1 0 15 47 1 0 16 48 1 0 17 49 1 0 17 50 1 0 18 51 1 0 19 52 1 0 20 53 1 0 20 54 1 0 21 55 1 0 22 56 1 0 23 57 1 0 23 58 1 0 24 59 1 0 25 60 1 0 26 61 1 0 26 62 1 0 27 63 1 0 27 64 1 0 28 65 1 0 28 66 1 0 29 67 1 0 29 68 1 0 30 69 1 0 30 70 1 0 31 71 1 0 M END