HMDB0289212 RDKit 3D PC(20:3(6,8,11)-OH(5)/DiMe(13,5)) 156156 0 0 0 0 0 0 0 0999 V2000 0.5231 0.1794 2.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6563 -1.2529 2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0699 -1.7366 2.7229 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2803 -3.1609 2.2502 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0251 -3.3067 0.7822 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2393 -4.7348 0.2915 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9736 -4.8101 -1.2059 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1618 -6.1822 -1.7586 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -7.1457 -1.1301 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3628 -7.8179 -1.8864 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5705 -8.7931 -1.2615 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9542 -8.3434 -1.5403 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2318 -7.2611 -2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6278 -6.8501 -2.4918 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8925 -5.7623 -3.1995 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3051 -5.3951 -3.4187 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9728 -6.5448 -3.8623 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4964 -4.3537 -4.5029 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7652 -3.0904 -4.2005 C 0 0 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0 0 0 0 0 0 0 0 0 0 0 0 6.1393 -1.1826 -1.0612 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3767 -1.2239 -0.8417 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1253 1.1418 -1.7589 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9936 0.1564 -2.7431 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3267 1.6107 -2.3005 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4057 1.0996 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3799 2.4798 -1.1543 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0733 -1.4851 3.4512 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7513 -0.9427 3.9233 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2816 -1.1621 2.1688 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2464 1.0652 5.5852 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7765 1.7126 6.3873 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7871 0.0128 5.8213 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 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 2 0 15 16 1 0 16 17 1 0 16 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 27 28 1 0 28 29 2 0 28 30 1 0 28 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 34 36 1 0 34 37 1 0 25 38 1 0 38 39 1 0 39 40 2 0 39 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 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 55 61 2 0 61 62 1 0 61 63 1 0 63 64 1 0 63 53 2 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 3 71 1 0 4 72 1 0 4 73 1 0 5 74 1 0 5 75 1 0 6 76 1 0 6 77 1 0 7 78 1 0 7 79 1 0 8 80 1 0 8 81 1 0 9 82 1 0 10 83 1 0 11 84 1 0 11 85 1 0 12 86 1 0 13 87 1 0 14 88 1 0 15 89 1 0 16 90 1 0 17 91 1 0 18 92 1 0 18 93 1 0 19 94 1 0 19 95 1 0 20 96 1 0 20 97 1 0 24 98 1 0 24 99 1 0 25100 1 1 26101 1 0 26102 1 0 32103 1 0 32104 1 0 33105 1 0 33106 1 0 35107 1 0 35108 1 0 35109 1 0 36110 1 0 36111 1 0 36112 1 0 37113 1 0 37114 1 0 37115 1 0 41116 1 0 41117 1 0 42118 1 0 42119 1 0 43120 1 0 43121 1 0 44122 1 0 44123 1 0 45124 1 0 45125 1 0 46126 1 0 46127 1 0 47128 1 0 47129 1 0 48130 1 0 48131 1 0 49132 1 0 49133 1 0 50134 1 0 50135 1 0 51136 1 0 51137 1 0 52138 1 0 52139 1 0 56140 1 0 56141 1 0 57142 1 0 57143 1 0 58144 1 0 58145 1 0 59146 1 0 59147 1 0 60148 1 0 60149 1 0 60150 1 0 62151 1 0 62152 1 0 62153 1 0 64154 1 0 64155 1 0 64156 1 0 M CHG 2 30 -1 34 1 M END