HMDB0289688 RDKit 3D PC(18:1(12Z)-2OH(9,10)/P-18:1(11Z)) 139138 0 0 0 0 0 0 0 0999 V2000 4.2910 -6.3528 -6.9135 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8676 -6.5720 -7.3083 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9074 -5.6344 -6.6731 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0143 -4.1941 -6.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2615 -3.4960 -6.5353 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1304 -2.0496 -6.9026 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1708 -1.1123 -6.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3392 -1.2768 -4.5546 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5852 -0.5411 -4.0434 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4567 0.8280 -4.3291 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5597 -0.7182 -2.5357 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2853 -0.2259 -2.1439 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5942 0.1618 -1.8415 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4495 -0.1211 -0.3488 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4039 0.7276 0.4169 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2064 0.4419 1.9206 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5257 -0.9592 2.2455 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3786 -1.3501 3.6759 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0104 -1.2479 4.2494 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4888 0.1284 4.3086 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2274 1.0628 4.6799 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1944 0.4381 3.9654 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6932 1.7554 4.0317 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2767 1.6888 3.4872 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6332 3.0058 3.3114 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5888 2.8279 2.6492 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3195 4.3217 2.4072 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.3231 4.5289 3.5404 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1927 5.5937 2.5545 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.1485 4.4109 0.9542 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9079 3.3614 0.0863 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7384 3.6009 -1.1582 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4113 4.8205 -1.8224 N 0 0 0 0 0 4 0 0 0 0 0 0 -1.1538 4.7372 -2.5587 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3309 5.9783 -0.9606 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4264 5.1280 -2.8239 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5206 0.7606 4.2749 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0026 -0.5696 4.2977 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1009 -1.2217 3.1695 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5832 -2.6025 3.0090 C 0 0 0 0 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20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 27 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 33 35 1 0 33 36 1 0 24 37 1 0 37 38 1 0 38 39 2 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 2 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 1 56 1 0 1 57 1 0 1 58 1 0 2 59 1 0 2 60 1 0 3 61 1 0 3 62 1 0 4 63 1 0 4 64 1 0 5 65 1 0 5 66 1 0 6 67 1 0 7 68 1 0 8 69 1 0 8 70 1 0 9 71 1 6 10 72 1 0 11 73 1 6 12 74 1 0 13 75 1 0 13 76 1 0 14 77 1 0 14 78 1 0 15 79 1 0 15 80 1 0 16 81 1 0 16 82 1 0 17 83 1 0 17 84 1 0 18 85 1 0 18 86 1 0 19 87 1 0 19 88 1 0 23 89 1 0 23 90 1 0 24 91 1 6 25 92 1 0 25 93 1 0 31 94 1 0 31 95 1 0 32 96 1 0 32 97 1 0 34 98 1 0 34 99 1 0 34100 1 0 35101 1 0 35102 1 0 35103 1 0 36104 1 0 36105 1 0 36106 1 0 38107 1 0 39108 1 0 40109 1 0 40110 1 0 41111 1 0 41112 1 0 42113 1 0 42114 1 0 43115 1 0 43116 1 0 44117 1 0 44118 1 0 45119 1 0 45120 1 0 46121 1 0 46122 1 0 47123 1 0 47124 1 0 48125 1 0 49126 1 0 50127 1 0 50128 1 0 51129 1 0 51130 1 0 52131 1 0 52132 1 0 53133 1 0 53134 1 0 54135 1 0 54136 1 0 55137 1 0 55138 1 0 55139 1 0 M CHG 2 29 -1 33 1 M END