HMDB0289540 RDKit 3D PC(20:4(5Z,8Z,11Z,14Z)-OH(18R)/P-18:0) 140139 0 0 0 0 0 0 0 0999 V2000 2.4907 -5.1479 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4517 -4.2002 -0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6549 -4.0209 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5493 -5.3199 1.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2645 -6.0286 1.4061 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9595 -5.3608 1.9201 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9069 -5.0809 3.4046 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1692 -4.4856 3.8974 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7214 -3.2364 3.4063 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0771 -1.9245 3.5497 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7949 -1.7606 2.8592 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2074 -0.3413 3.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0899 0.0103 4.4012 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5284 1.3952 4.6666 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6939 2.0016 4.0215 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5931 2.2673 2.5746 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8463 2.8888 2.0234 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7782 4.0929 1.4963 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9071 4.7552 0.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9199 4.9026 -0.4539 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7053 5.7104 -0.9138 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 5.7894 -2.3037 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6913 6.4760 -2.9939 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8004 7.0974 -2.3705 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6864 6.4856 -4.4963 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3082 6.0088 -4.9935 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0557 4.6157 -4.4273 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2193 4.0162 -4.8123 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1948 3.6785 -3.9638 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9933 3.9295 -2.5171 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0007 2.7251 -1.6709 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8619 2.5718 -0.7096 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9269 3.5506 -0.3484 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6405 4.0395 1.0096 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4612 3.8897 2.0051 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7855 3.2263 1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7225 2.1133 2.9876 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9068 0.8710 2.7071 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2118 0.2438 1.4215 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5524 -0.4834 1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9300 -1.1819 0.3100 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.9534 -2.1205 -0.0386 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1994 -1.9870 0.5692 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6745 -2.7411 -0.6392 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1075 3.6327 -1.2238 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1579 2.6626 -0.9947 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4116 1.2833 -1.9120 P 0 0 0 0 0 5 0 0 0 0 0 0 2.0392 0.7402 -2.3077 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2738 1.6625 -3.3276 O 0 0 0 0 0 1 0 0 0 0 0 0 4.2029 0.0515 -1.0989 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3093 0.5120 -0.4242 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0391 -0.5925 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5230 -1.6388 -0.5296 N 0 0 0 0 0 4 0 0 0 0 0 0 7.8033 -2.1026 0.0336 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6526 -2.7955 -0.5852 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7806 -1.1860 -1.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6168 -5.0013 -2.3798 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1131 -6.2110 -1.1969 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4393 -5.0241 -0.7416 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6202 -3.1989 -1.1663 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -4.5162 -0.9878 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9238 -3.2950 1.1666 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6513 -3.5515 0.9044 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8229 -5.1488 2.6026 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3847 -5.9707 1.1412 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3568 -6.9935 1.9989 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0931 -6.4232 0.3575 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8948 -5.9065 1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0913 -4.3626 1.4169 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0143 -4.5290 3.6396 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8599 -6.1114 3.9481 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1789 -4.5185 5.0606 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9659 -5.3087 3.7122 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -3.1782 3.7703 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9518 -3.4262 2.2795 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0664 -1.5634 4.6164 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8137 -1.1672 3.0892 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8872 -1.8772 1.7624 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.4110 3.1952 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7775 0.3359 2.3954 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8013 -0.4953 2.4981 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9097 -0.6780 4.8374 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7463 -0.1939 5.1319 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6687 1.5545 5.8006 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3539 2.1235 4.4855 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8478 3.0148 4.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6302 1.4262 4.2925 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3928 1.4204 1.9632 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7567 3.0165 2.4378 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7819 2.3664 2.0625 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8156 4.6213 1.4701 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8426 5.5409 -0.6601 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8123 5.2489 -0.4601 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 6.7426 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8414 7.4970 -4.8907 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4784 5.8278 -4.8752 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3724 5.9627 -6.0991 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4948 6.7117 -4.7283 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3778 4.5454 -3.4025 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8522 3.9852 -4.9879 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4671 3.7961 -5.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1136 3.2315 -4.3246 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0904 4.5608 -2.3002 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 4.5968 -2.2129 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 1.9089 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 1.6518 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9160 2.9705 -0.3196 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1110 4.3458 -1.0669 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6687 4.5506 1.1424 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1062 4.3208 2.9823 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0316 2.8300 1.0316 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5904 3.9534 2.3225 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4994 2.4010 4.0246 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8225 0.1499 3.5739 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4835 -0.5337 1.1189 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3856 0.9916 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3329 0.3029 1.7758 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4685 -1.1569 2.4382 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0909 -0.4811 -0.5068 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5163 -1.9049 -0.8866 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9823 -2.6835 1.4315 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9924 -1.3045 0.9358 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3000 -3.8056 -0.6038 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7913 -2.8380 -0.6083 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3673 -2.2890 -1.5957 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1014 3.2152 -0.9333 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1993 3.8634 -2.3272 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9587 1.2121 0.3642 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0014 1.0286 -1.1322 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9254 -0.0907 0.7845 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4210 -1.0173 1.1061 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4669 -1.2332 0.2526 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5709 -2.5728 1.0078 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2750 -2.8660 -0.6054 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2705 -2.9846 0.4459 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8350 -2.6618 -1.3207 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1997 -3.7087 -0.9038 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3760 -0.2477 -1.8993 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8174 -1.0904 -2.4432 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3591 -1.9738 -2.4097 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 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 1 0 34 35 2 0 35 36 1 0 36 37 1 0 37 38 2 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 41 43 1 0 43 44 1 0 20 45 1 0 45 46 1 0 46 47 1 0 47 48 2 0 47 49 1 0 47 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 53 55 1 0 53 56 1 0 1 57 1 0 1 58 1 0 1 59 1 0 2 60 1 0 2 61 1 0 3 62 1 0 3 63 1 0 4 64 1 0 4 65 1 0 5 66 1 0 5 67 1 0 6 68 1 0 6 69 1 0 7 70 1 0 7 71 1 0 8 72 1 0 8 73 1 0 9 74 1 0 9 75 1 0 10 76 1 0 10 77 1 0 11 78 1 0 11 79 1 0 12 80 1 0 12 81 1 0 13 82 1 0 13 83 1 0 14 84 1 0 14 85 1 0 15 86 1 0 15 87 1 0 16 88 1 0 16 89 1 0 17 90 1 0 18 91 1 0 20 92 1 1 21 93 1 0 21 94 1 0 25 95 1 0 25 96 1 0 26 97 1 0 26 98 1 0 27 99 1 0 27100 1 0 28101 1 0 29102 1 0 30103 1 0 30104 1 0 31105 1 0 32106 1 0 33107 1 0 33108 1 0 34109 1 0 35110 1 0 36111 1 0 36112 1 0 37113 1 0 38114 1 0 39115 1 0 39116 1 0 40117 1 0 40118 1 0 41119 1 6 42120 1 0 43121 1 0 43122 1 0 44123 1 0 44124 1 0 44125 1 0 45126 1 0 45127 1 0 51128 1 0 51129 1 0 52130 1 0 52131 1 0 54132 1 0 54133 1 0 54134 1 0 55135 1 0 55136 1 0 55137 1 0 56138 1 0 56139 1 0 56140 1 0 M CHG 2 49 -1 53 1 M END