HMDB0294534 RDKit 3D DG(20:5(5Z,8Z,10E,14Z,17Z)-OH(12)/10:0/0:0) 93 92 0 0 0 0 0 0 0 0999 V2000 -11.8325 3.1926 -0.3174 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1258 1.9937 0.3385 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1806 1.0598 0.7442 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2572 -0.1536 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3290 -0.7730 -0.6439 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7021 -1.9555 0.0367 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4140 -2.0601 0.2463 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4015 -1.0659 -0.1368 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3866 -1.6568 -1.1019 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0534 -2.0773 -2.2312 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5307 -2.6637 -0.4673 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3871 -2.2584 0.1005 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4970 -3.2026 0.7442 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -2.8280 1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9210 -1.4313 1.3343 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6219 -1.4080 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3205 -0.7021 -0.4347 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 0.1766 -1.0527 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9717 1.6325 -1.0859 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7865 1.9929 -1.9045 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5056 1.3982 -1.5309 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1182 0.7264 -2.4272 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0992 1.5029 -0.3172 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 1.0618 0.2045 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5175 1.7338 -0.1744 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8953 1.9178 -1.5941 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 2.7348 -2.3257 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6390 1.0020 0.4275 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4351 1.5720 1.3877 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1646 2.7721 1.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5690 0.9285 2.0532 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8926 1.1320 1.2711 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7689 0.5300 -0.0695 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9197 0.5951 -0.9757 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1751 -0.1626 -0.7087 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8241 0.1420 0.5721 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1631 -0.4510 0.8574 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3112 -1.9110 0.9407 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0089 -2.6224 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6901 3.5317 0.3105 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0517 3.9965 -0.4052 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1748 2.8407 -1.3113 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3936 1.6327 -0.3835 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6157 2.4631 1.2378 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9235 1.4473 1.4582 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0974 -0.7643 0.6817 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9979 -1.2529 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6196 -0.1484 -1.1504 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3424 -2.7887 0.3838 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0522 -2.9763 0.7577 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7667 -0.1471 -0.6068 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8772 -0.7111 0.8021 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7451 -0.7934 -1.4145 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9581 -1.4401 -3.0039 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7403 -3.7198 -0.4137 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1768 -1.2167 0.0573 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8059 -4.2829 0.7451 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7196 -3.5562 1.7848 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6446 -1.1650 2.4231 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6284 -0.6690 1.0438 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8318 -2.0583 1.0677 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2947 -0.7955 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2911 -0.1285 -2.1728 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3578 0.0019 -0.7228 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8477 2.1944 -1.5061 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7842 2.0328 -0.0506 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7096 3.1233 -1.9192 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0307 1.7704 -2.9953 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3452 -0.0730 0.0855 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 1.1445 1.3369 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5253 2.7367 0.3641 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9349 2.3635 -1.6982 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0267 0.9129 -2.1088 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2604 2.6431 -3.2827 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4227 -0.1572 2.2266 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7332 1.3924 3.0401 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7345 0.9749 1.8944 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8697 2.2764 1.1076 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8841 1.0030 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3759 -0.5466 0.0344 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5900 0.4240 -2.0596 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1876 1.7212 -1.0382 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8702 0.0121 -1.6007 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8550 -1.2602 -0.7672 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8386 1.2064 0.7887 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1618 -0.4356 1.3499 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5515 -0.0201 1.8289 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9175 -0.0268 0.1088 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3794 -2.1979 1.2172 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7327 -2.3417 1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0425 -3.1822 -0.3409 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0400 -1.9831 -1.2225 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7951 -3.4211 -0.5514 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 2 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 2 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 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 26 27 1 0 25 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 1 40 1 0 1 41 1 0 1 42 1 0 2 43 1 0 2 44 1 0 3 45 1 0 4 46 1 0 5 47 1 0 5 48 1 0 6 49 1 0 7 50 1 0 8 51 1 0 8 52 1 0 9 53 1 0 10 54 1 0 11 55 1 0 12 56 1 0 13 57 1 0 14 58 1 0 15 59 1 0 15 60 1 0 16 61 1 0 17 62 1 0 18 63 1 0 18 64 1 0 19 65 1 0 19 66 1 0 20 67 1 0 20 68 1 0 24 69 1 0 24 70 1 0 25 71 1 1 26 72 1 0 26 73 1 0 27 74 1 0 31 75 1 0 31 76 1 0 32 77 1 0 32 78 1 0 33 79 1 0 33 80 1 0 34 81 1 0 34 82 1 0 35 83 1 0 35 84 1 0 36 85 1 0 36 86 1 0 37 87 1 0 37 88 1 0 38 89 1 0 38 90 1 0 39 91 1 0 39 92 1 0 39 93 1 0 M END