HMDB0288455 RDKit 3D PC(22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)/22:5(7Z,10Z,13Z,16Z,19Z)) 146145 0 0 0 0 0 0 0 0999 V2000 -5.5319 -2.8485 -9.0742 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8269 -1.8316 -8.1669 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6826 -0.6514 -8.0044 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1395 -0.2101 -6.8656 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8570 -0.8481 -5.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1639 0.1253 -4.6613 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9729 -0.0128 -4.1249 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1870 -1.2493 -4.3826 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8950 -1.9066 -3.1031 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6714 -2.1395 -2.7232 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4478 -1.7953 -3.4891 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4157 -0.8885 -2.7156 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6354 -1.1618 -2.4116 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3149 -2.4079 -2.7968 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7615 -3.1097 -1.6073 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3849 -4.3221 -1.2943 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4869 -5.0838 -2.0929 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2191 -5.6521 -1.5683 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2761 -6.7037 -0.5556 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7666 -6.5233 0.8118 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0371 -5.7471 1.8026 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3546 -4.3764 1.7313 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4993 -4.0838 1.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3613 -3.2682 2.1684 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1376 -1.9687 2.1281 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5434 -1.0014 1.2006 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0012 0.2855 1.3978 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3066 1.4315 0.7311 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1432 1.3763 -0.1885 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2906 2.7428 1.0431 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0912 3.8562 0.1321 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4499 3.6516 -1.2736 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0635 4.7325 -2.1706 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5424 4.5962 -3.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9144 3.3085 -3.8713 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1022 2.3469 -3.7886 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2351 2.7657 -3.5961 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9494 3.0474 -2.5125 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2706 2.4426 -2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0537 2.6327 -1.3237 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6575 3.5246 -0.2099 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6944 4.5736 -0.1466 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4448 4.7690 0.9017 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3056 3.9583 2.0879 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1173 4.2007 3.1332 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0040 3.3973 4.3546 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5010 4.1733 5.4172 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8968 2.1531 4.2436 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4684 1.3548 3.0905 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0170 0.1202 3.1127 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8621 -0.6886 4.3354 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3843 -1.0676 4.4614 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2326 -1.3355 3.5007 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7558 -0.0659 3.3379 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9521 0.7878 4.7730 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.8387 -0.1975 5.9194 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2594 1.9489 4.9742 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.4927 1.5485 4.8002 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4044 0.5201 4.6006 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8376 0.9740 4.5742 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1238 1.9235 3.5359 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.6508 3.2616 3.8405 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7047 1.4959 2.2186 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5923 2.0275 3.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1026 -3.5673 -8.4876 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7462 -3.3377 -9.7103 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1839 -2.2611 -9.7462 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5254 -2.3067 -7.2457 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8718 -1.5372 -8.6852 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9522 -0.1044 -8.9303 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7795 0.6960 -6.8839 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4641 -1.8379 -5.5989 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9261 -0.9750 -5.1018 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7495 1.0542 -4.4653 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5748 0.7720 -3.5037 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 -1.9440 -5.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2437 -0.9358 -4.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7331 -2.2107 -2.4454 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5194 -2.6268 -1.7639 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1409 -2.7544 -3.6699 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5982 -1.4041 -4.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0168 0.0663 -2.3721 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2414 -0.4321 -1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3192 -1.9847 -3.2648 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9455 -2.9588 -3.6406 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4637 -2.5670 -0.9333 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8134 -4.7586 -0.3691 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0967 -6.0429 -2.3839 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2609 -4.6974 -3.1083 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3959 -6.0464 -2.4441 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -4.8386 -1.1728 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8277 -7.0529 -0.4299 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6966 -7.6752 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7771 -7.6311 1.2377 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8611 -6.2855 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9104 -6.3448 2.1062 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -5.8352 2.8108 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2118 -2.0115 1.7234 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4743 -1.3234 0.1448 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 -0.9440 1.4537 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0393 3.0406 2.0736 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4104 2.6456 1.1353 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 4.8371 0.4897 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1963 3.9344 0.1166 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2348 2.6365 -1.5503 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5721 3.7129 -1.1466 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3336 5.7514 -1.7967 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7561 5.5596 -3.8406 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9153 3.4961 -5.0276 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 1.6184 -4.4421 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7297 2.0669 -4.3027 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5598 3.7220 -1.7736 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6176 1.7676 -3.1332 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0204 2.1165 -1.3107 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 2.9821 0.7284 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6800 4.0267 -0.3461 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8777 5.2452 -0.9996 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2170 5.5714 0.9058 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5926 3.1649 2.2171 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8344 4.9897 3.0308 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9715 3.1249 4.5682 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7285 4.6141 5.8354 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8653 1.5970 5.1741 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9631 2.4843 4.1163 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5452 1.8482 2.1042 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7349 -0.3372 2.1419 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1863 -0.1802 5.2315 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3893 -1.6714 4.2458 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0942 -1.5644 3.5205 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2219 -1.7436 5.3298 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7780 -0.1257 4.5649 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8362 -1.2475 3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8164 -1.9794 4.1797 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3057 -0.1574 5.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1127 -0.0768 3.7397 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1915 1.3735 5.5194 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4507 0.0644 4.3552 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2670 4.0191 3.2709 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8802 3.4552 4.8983 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6027 3.3619 3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4672 0.8106 1.8001 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7474 2.4208 1.5726 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6925 1.0819 2.1702 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8896 2.7313 2.6858 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9127 2.2850 4.4878 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9356 0.9937 3.2714 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 2 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 28 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 2 0 34 35 1 0 35 36 1 0 35 37 1 0 37 38 2 0 38 39 1 0 39 40 2 0 40 41 1 0 41 42 1 0 42 43 2 0 43 44 1 0 44 45 2 0 45 46 1 0 46 47 1 0 46 48 1 0 48 49 1 0 49 50 2 0 50 51 1 0 51 52 1 0 25 53 1 0 53 54 1 0 54 55 1 0 55 56 2 0 55 57 1 0 55 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 61 63 1 0 61 64 1 0 1 65 1 0 1 66 1 0 1 67 1 0 2 68 1 0 2 69 1 0 3 70 1 0 4 71 1 0 5 72 1 0 5 73 1 0 6 74 1 0 7 75 1 0 8 76 1 0 8 77 1 0 9 78 1 0 10 79 1 0 11 80 1 0 11 81 1 0 12 82 1 0 13 83 1 0 14 84 1 0 14 85 1 0 15 86 1 0 16 87 1 0 17 88 1 0 17 89 1 0 18 90 1 0 18 91 1 0 19 92 1 0 19 93 1 0 20 94 1 0 20 95 1 0 21 96 1 0 21 97 1 0 25 98 1 6 26 99 1 0 26100 1 0 30101 1 0 30102 1 0 31103 1 0 31104 1 0 32105 1 0 32106 1 0 33107 1 0 34108 1 0 35109 1 6 36110 1 0 37111 1 0 38112 1 0 39113 1 0 40114 1 0 41115 1 0 41116 1 0 42117 1 0 43118 1 0 44119 1 0 45120 1 0 46121 1 1 47122 1 0 48123 1 0 48124 1 0 49125 1 0 50126 1 0 51127 1 0 51128 1 0 52129 1 0 52130 1 0 52131 1 0 53132 1 0 53133 1 0 59134 1 0 59135 1 0 60136 1 0 60137 1 0 62138 1 0 62139 1 0 62140 1 0 63141 1 0 63142 1 0 63143 1 0 64144 1 0 64145 1 0 64146 1 0 M CHG 2 57 -1 61 1 M END