HMDB0299846 RDKit 3D DG(20:4(7E,9E,11Z,13E)-3OH(5S,6R,15S)/0:0/i-19:0) 124123 0 0 0 0 0 0 0 0999 V2000 18.8014 0.2912 1.5111 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3373 0.5636 1.2808 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1973 1.0398 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7554 1.3272 -0.4631 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4929 1.8479 -1.8332 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8984 0.9064 -2.9054 C 0 0 1 0 0 0 0 0 0 0 0 0 17.2309 0.5825 -2.9635 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1486 -0.3978 -2.8021 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8976 -0.4773 -2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2399 -1.7624 -2.3404 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0024 -1.8580 -1.9589 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1546 -0.7517 -1.5751 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8969 -0.8472 -1.1943 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1080 0.3169 -0.8212 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8267 0.2086 -0.4425 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0324 1.3843 -0.0692 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6924 2.2069 -1.1569 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8752 1.1584 0.8285 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1345 0.3311 1.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6225 0.8085 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6971 -0.4176 -0.7691 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3870 -0.6544 -1.4694 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2447 -0.8759 -0.5667 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4411 -0.9857 0.6584 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9492 -0.9676 -1.0192 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1965 -1.1621 -0.2379 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3742 0.0314 0.6782 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5367 1.1981 -0.0413 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4843 -0.1667 1.6496 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7181 -0.2545 1.0607 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4487 0.6417 0.3443 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9757 1.7797 0.1455 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7754 0.2791 -0.1922 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2988 -0.9040 0.6247 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4546 -0.4498 2.0481 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9621 -1.4262 3.0123 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3436 -1.8333 3.0811 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1996 -2.2530 1.9614 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7188 -1.1207 1.1578 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5557 -1.5767 -0.0269 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7254 -2.4039 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7061 -1.7741 1.2973 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3648 -0.5073 0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3012 -0.0154 1.6774 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0734 1.2104 1.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9951 1.3996 0.4081 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3198 1.5455 -0.9136 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.3603 1.7146 -2.0247 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2689 0.5083 -2.0786 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1929 2.9320 -1.6706 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3738 1.2422 1.4964 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1872 -0.3264 0.6665 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9170 -0.2206 2.4871 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9862 1.4261 1.8959 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7143 -0.3252 1.4122 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5532 0.2160 -0.8464 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7872 1.9495 -0.3684 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1695 0.3697 -0.2862 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3201 2.0171 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3934 2.1087 -1.8929 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0295 2.8461 -1.9821 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5855 1.3380 -3.8921 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4273 -0.2756 -3.3754 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6439 -1.3451 -3.0556 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3757 0.4153 -2.1637 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7466 -2.6959 -2.5967 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5297 -2.8575 -1.9144 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5513 0.2512 -1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4409 -1.8148 -1.1601 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5476 1.2749 -0.8482 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4600 -0.8070 -0.4355 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7545 2.0596 0.5131 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1803 2.9558 -0.7745 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5928 2.1508 1.3309 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3840 0.3474 2.5307 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8182 0.7120 0.8139 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3569 1.7200 -0.5364 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8808 -1.3177 -0.1346 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4549 -0.3622 -1.5834 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1892 0.2318 -2.1297 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5167 -1.4971 -2.1969 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0695 -1.2974 -0.9104 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0637 -2.0973 0.3154 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6116 0.1662 1.2194 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1033 1.9134 0.1874 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4461 0.6271 2.4628 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2364 -1.1118 2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5264 1.0819 -0.1108 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6668 -0.0979 -1.2344 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1240 -1.4004 0.1685 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4065 -1.6504 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1177 0.4824 1.9913 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4825 -0.0134 2.4103 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2762 -2.3658 2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6423 -1.0529 4.0796 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8916 -0.9914 3.6803 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4136 -2.6512 3.9308 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6259 -2.9112 1.2537 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0244 -2.8942 2.3817 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9851 -0.4218 0.8331 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4122 -0.4670 1.8324 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8957 -2.2178 -0.6472 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8055 -0.6948 -0.6179 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2850 -2.6394 -0.5724 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3928 -3.4057 0.7369 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5561 -2.4727 1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3202 -1.4260 2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5917 0.1506 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9180 -0.9376 -0.2551 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6943 0.0437 2.6431 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0478 -0.8577 1.8692 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7210 1.2917 2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4146 2.1374 1.6666 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7412 0.5489 0.3781 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.6706 2.3075 0.5756 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5655 0.8297 -1.1612 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7654 2.5516 -0.8452 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8356 1.8184 -2.9907 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.0535 0.5142 -1.3152 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.7650 0.5233 -3.0806 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.6588 -0.4204 -2.0635 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.6243 3.6033 -0.9921 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.0662 2.5611 -1.0807 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4972 3.4422 -2.5949 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 1 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 18 20 1 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 27 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 31 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 48 50 1 0 1 51 1 0 1 52 1 0 1 53 1 0 2 54 1 0 2 55 1 0 3 56 1 0 3 57 1 0 4 58 1 0 4 59 1 0 5 60 1 0 5 61 1 0 6 62 1 6 7 63 1 0 8 64 1 0 9 65 1 0 10 66 1 0 11 67 1 0 12 68 1 0 13 69 1 0 14 70 1 0 15 71 1 0 16 72 1 1 17 73 1 0 18 74 1 1 19 75 1 0 20 76 1 0 20 77 1 0 21 78 1 0 21 79 1 0 22 80 1 0 22 81 1 0 26 82 1 0 26 83 1 0 27 84 1 1 28 85 1 0 29 86 1 0 29 87 1 0 33 88 1 0 33 89 1 0 34 90 1 0 34 91 1 0 35 92 1 0 35 93 1 0 36 94 1 0 36 95 1 0 37 96 1 0 37 97 1 0 38 98 1 0 38 99 1 0 39100 1 0 39101 1 0 40102 1 0 40103 1 0 41104 1 0 41105 1 0 42106 1 0 42107 1 0 43108 1 0 43109 1 0 44110 1 0 44111 1 0 45112 1 0 45113 1 0 46114 1 0 46115 1 0 47116 1 0 47117 1 0 48118 1 0 49119 1 0 49120 1 0 49121 1 0 50122 1 0 50123 1 0 50124 1 0 M END