HMDB0258281 RDKit 3D sialyl Lewis(x) 108111 0 0 0 0 0 0 0 0999 V2000 8.0667 3.4912 1.2851 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6999 2.9668 1.7671 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1332 3.8177 2.5056 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3173 1.7636 1.3748 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9150 0.4997 0.9629 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2532 -0.2579 2.1267 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7008 -1.5419 2.2639 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7786 -0.1365 2.0979 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2201 -0.5878 0.7659 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0663 0.0322 0.4451 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2076 -0.3517 -0.4882 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0467 0.5195 -1.7548 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0817 0.3940 -2.6304 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1826 -0.1123 -2.4357 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0233 -0.0482 -3.9389 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2086 -0.4369 -4.5826 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4545 -1.4019 -1.9849 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9345 -1.4792 -0.7151 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3202 -1.3832 -0.6552 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8443 -2.2219 0.3367 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5582 -3.4300 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5559 -4.5254 -0.5521 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6991 -4.8295 0.5128 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2410 -4.0434 0.9354 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0623 -3.5246 2.1878 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8299 -3.6466 2.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4662 -2.0512 2.2093 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8813 -1.9481 2.0873 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6632 -1.7615 0.9218 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1692 -1.6686 1.0831 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2742 -1.6636 -0.2458 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6231 -1.3186 1.2416 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3902 -0.3578 0.5952 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8058 0.9043 0.6013 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3556 1.7409 1.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8513 2.9237 1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4501 3.7048 2.2035 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9358 2.6060 0.0394 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8843 1.7729 0.6018 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2153 2.0192 -1.1577 C 0 0 0 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0 14 69 1 0 15 70 1 0 15 71 1 0 16 72 1 0 18 73 1 0 20 74 1 0 21 75 1 0 22 76 1 0 22 77 1 0 23 78 1 0 25 79 1 0 26 80 1 0 27 81 1 0 28 82 1 0 30 83 1 0 30 84 1 0 30 85 1 0 32 86 1 0 34 87 1 0 36 88 1 0 37 89 1 0 37 90 1 0 37 91 1 0 38 92 1 0 39 93 1 0 40 94 1 0 41 95 1 0 42 96 1 0 43 97 1 0 44 98 1 0 45 99 1 0 48100 1 0 50101 1 0 51102 1 0 52103 1 0 53104 1 0 54105 1 0 55106 1 0 55107 1 0 56108 1 0 M END