HMDB0254271 RDKit 3D Lysophosphatidylcholine 41 40 0 0 0 0 0 0 0 0999 V2000 7.7910 -1.0917 0.3756 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -0.3257 0.2471 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4388 0.9017 0.1357 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3306 -1.0716 0.2526 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0779 -0.5807 0.1452 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5134 0.3449 1.1909 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3191 -0.1921 2.4087 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2969 1.0384 0.5235 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 0.1515 0.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1091 0.5118 -0.6036 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.2138 -0.9840 -1.2013 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9654 1.1192 -2.0338 O 0 0 0 0 0 1 0 0 0 0 0 0 -1.2680 1.2726 -0.5652 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3272 0.9812 0.2414 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3534 0.3267 -0.7374 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5834 -0.0645 -0.2259 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.4977 -0.8948 0.9004 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2413 -0.8436 -1.2957 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4594 1.0902 -0.0178 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8954 -1.7571 -0.5137 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7006 -1.6831 1.2836 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6570 -0.4290 0.3748 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0518 0.0676 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3233 -1.3918 -0.0947 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2735 1.1810 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6761 -0.9873 2.3717 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6179 1.2385 -0.5172 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0291 1.9836 1.0246 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8578 1.9784 0.4502 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1866 0.4735 1.1525 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8327 -0.7323 -0.9579 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2665 0.8172 -1.7058 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5863 -0.8766 1.5025 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3750 -0.6407 1.5632 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6548 -1.9806 0.6117 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0685 -0.3276 -2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3007 -0.9157 -1.0972 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7493 -1.8472 -1.3804 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3012 1.5229 0.9686 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4847 0.7817 -0.1738 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1970 1.8349 -0.8256 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 10 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 16 18 1 0 16 19 1 0 1 20 1 0 1 21 1 0 1 22 1 0 5 23 1 0 5 24 1 0 6 25 1 0 7 26 1 0 8 27 1 0 8 28 1 0 14 29 1 0 14 30 1 0 15 31 1 0 15 32 1 0 17 33 1 0 17 34 1 0 17 35 1 0 18 36 1 0 18 37 1 0 18 38 1 0 19 39 1 0 19 40 1 0 19 41 1 0 M CHG 2 12 -1 16 1 M END