HMDB0289581 RDKit 3D PC(P-18:0/18:2(9Z,11E)+=O(13)) 136135 0 0 0 0 0 0 0 0999 V2000 5.7789 -1.5236 2.3829 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7852 -1.8412 3.4917 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5146 -3.3193 3.4832 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5528 -3.7375 4.5541 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1989 -3.0358 4.3768 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2517 -3.4681 5.4474 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1389 -2.8137 5.2976 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0007 -1.3496 5.3704 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1553 -0.4572 5.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0875 -0.3482 4.2409 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8793 -1.5577 3.9024 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8571 -1.1968 2.7383 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6317 -2.4458 2.4386 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6299 -2.2383 1.3238 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9487 -1.8257 0.0493 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0165 -1.6257 -1.0277 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3093 -1.2128 -2.2735 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6355 -0.0178 -2.7887 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0323 0.4359 -3.9318 O 0 0 0 0 0 0 0 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33 1 0 21 34 1 0 34 35 1 0 35 36 2 0 35 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 2 0 45 46 1 0 46 47 2 0 47 48 1 0 48 49 2 0 48 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 1 55 1 0 1 56 1 0 1 57 1 0 2 58 1 0 2 59 1 0 3 60 1 0 3 61 1 0 4 62 1 0 4 63 1 0 5 64 1 0 5 65 1 0 6 66 1 0 6 67 1 0 7 68 1 0 7 69 1 0 8 70 1 0 8 71 1 0 9 72 1 0 9 73 1 0 10 74 1 0 10 75 1 0 11 76 1 0 11 77 1 0 12 78 1 0 12 79 1 0 13 80 1 0 13 81 1 0 14 82 1 0 14 83 1 0 15 84 1 0 15 85 1 0 16 86 1 0 16 87 1 0 17 88 1 0 18 89 1 0 20 90 1 0 20 91 1 0 21 92 1 1 22 93 1 0 22 94 1 0 28 95 1 0 28 96 1 0 29 97 1 0 29 98 1 0 31 99 1 0 31100 1 0 31101 1 0 32102 1 0 32103 1 0 32104 1 0 33105 1 0 33106 1 0 33107 1 0 37108 1 0 37109 1 0 38110 1 0 38111 1 0 39112 1 0 39113 1 0 40114 1 0 40115 1 0 41116 1 0 41117 1 0 42118 1 0 42119 1 0 43120 1 0 43121 1 0 44122 1 0 45123 1 0 46124 1 0 47125 1 0 50126 1 0 50127 1 0 51128 1 0 51129 1 0 52130 1 0 52131 1 0 53132 1 0 53133 1 0 54134 1 0 54135 1 0 54136 1 0 M CHG 2 26 -1 30 1 M END