HMDB0006568 RDKit 3D Lewis X trisaccharide 71 72 0 0 0 0 0 0 0 0999 V2000 -1.1498 5.3392 -0.6815 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1626 4.4079 -1.2752 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2379 4.6080 -2.4419 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3313 3.3022 -0.5478 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2894 2.4089 -1.1552 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6362 2.7254 -0.5521 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8028 3.6011 0.2709 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9248 0.9426 -0.9375 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9005 0.7476 0.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9563 -0.0848 0.7973 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3803 -1.2680 1.2929 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 -2.2846 1.3817 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6298 -2.9472 0.0774 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6007 -1.7443 2.0649 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5381 -1.4172 1.0971 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2446 -0.4875 2.8543 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3454 -0.0993 3.5958 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8398 0.5628 1.8248 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1021 1.5746 2.4683 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3862 0.6274 -1.5552 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7317 -0.6945 -1.2592 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8738 -0.8374 -0.5220 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6025 -1.3352 0.7779 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7488 -1.1117 1.5169 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5606 -1.4107 2.9868 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7748 -1.1506 3.6259 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9731 -1.8040 1.0222 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0013 -3.1640 1.3457 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1651 -1.5883 -0.4651 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1529 -2.3784 -0.9946 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7998 -1.8457 -1.1292 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9548 -1.7536 -2.4797 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4364 0.9656 -3.0051 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7711 0.8055 -3.4877 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4781 0.1892 -3.8933 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8079 0.2411 -3.6133 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7357 5.6863 0.3005 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 6.2332 -1.3147 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1491 4.8747 -0.5388 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0156 3.1458 0.4458 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 2.6409 -2.2166 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4666 2.1281 -0.8891 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7509 0.3627 -1.3821 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5313 -0.3087 -0.1219 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9235 -3.0448 2.0772 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 -2.3352 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1423 -3.9350 -0.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7361 -3.1450 -0.0261 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 -2.4834 2.7403 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4089 -1.8254 1.2879 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3621 -0.7090 3.4949 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0838 -0.7409 3.4894 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7657 0.9275 1.3594 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5124 1.7977 3.3456 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1686 1.2470 -1.0392 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4162 0.1037 -0.3356 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9499 -0.0052 1.4574 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3052 -2.4735 3.1724 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -0.7115 3.4583 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 -0.3624 3.2128 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8489 -1.3477 1.5281 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9509 -3.4476 1.3104 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3594 -0.5042 -0.6009 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8431 -3.3140 -1.0081 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4415 -2.8762 -0.8186 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7994 -2.6385 -2.9062 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2469 2.0429 -3.1389 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9598 1.4462 -4.2085 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1867 -0.9002 -3.9464 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 0.5282 -4.9643 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3953 0.3007 -4.4271 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 2 0 5 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 8 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 24 27 1 0 27 28 1 0 27 29 1 0 29 30 1 0 29 31 1 0 31 32 1 0 20 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 18 10 1 0 31 22 1 0 1 37 1 0 1 38 1 0 1 39 1 0 4 40 1 0 5 41 1 6 6 42 1 0 8 43 1 6 10 44 1 6 12 45 1 1 13 46 1 0 13 47 1 0 13 48 1 0 14 49 1 1 15 50 1 0 16 51 1 1 17 52 1 0 18 53 1 6 19 54 1 0 20 55 1 1 22 56 1 1 24 57 1 1 25 58 1 0 25 59 1 0 26 60 1 0 27 61 1 1 28 62 1 0 29 63 1 1 30 64 1 0 31 65 1 6 32 66 1 0 33 67 1 1 34 68 1 0 35 69 1 0 35 70 1 0 36 71 1 0 M END