HMDB0006582 RDKit 3D Lewis a trisaccharide 71 72 0 0 0 0 0 0 0 0999 V2000 -1.4673 3.6681 -2.9814 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5825 4.3859 -1.5994 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9694 5.5545 -1.7759 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2788 3.7205 -0.4637 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9695 3.0439 0.6956 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1458 3.0861 1.6594 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1406 3.7396 1.4535 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4095 1.6527 0.5738 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1936 0.8787 -0.2103 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9802 -0.1230 0.2233 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4486 -1.3127 -0.3201 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0706 -2.4111 0.2079 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3446 -3.6720 -0.2647 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9609 -4.8274 0.2156 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5051 -2.4423 -0.3484 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3496 -2.1624 -1.7211 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1832 -1.2476 0.2686 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.5223 -1.1354 -0.0339 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4344 -0.0163 -0.2238 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0355 1.0643 0.3673 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0537 1.5108 0.4707 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4896 0.2794 0.8815 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1431 -0.5436 0.0328 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3243 -1.6450 -0.2837 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9694 -2.4894 -1.1784 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4038 -1.8053 -2.4519 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1545 -3.1546 -0.5476 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3288 -2.9763 -1.2753 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4125 -2.5745 0.8326 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7062 -2.9425 1.1804 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4130 -1.0590 0.7038 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5186 -0.5970 2.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9159 2.6594 0.8596 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1711 2.4571 0.1642 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3508 2.7727 2.2854 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3462 2.9014 3.2322 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4793 4.3891 -3.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3359 3.0118 -3.0424 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5153 3.0980 -2.9084 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4944 4.8661 0.2835 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2386 3.6884 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0802 2.5051 2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 1.2183 1.6599 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9641 -0.2687 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1294 -2.3942 1.3123 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3208 -3.7313 -1.3597 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3267 -3.6905 0.1439 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7041 -5.0940 -0.3725 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0131 -3.3980 -0.1711 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1995 -1.7615 -2.0633 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9926 -1.2620 1.3825 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0707 -1.4935 0.7367 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5102 0.0855 -1.3282 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 1.3471 -0.0273 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2618 1.4577 -0.6884 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3926 -0.1098 -0.9471 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2699 -3.2867 -1.4914 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6255 -2.6462 -3.1666 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -1.2279 -2.9234 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3429 -1.2489 -2.3361 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0091 -4.2507 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0522 -3.5777 -1.0046 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6316 -2.9610 1.4978 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9911 -2.5911 2.0401 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3225 -0.7988 0.1676 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4348 -0.3846 2.2701 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5424 3.5985 0.4274 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 3.2301 -0.4179 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0480 3.6965 2.3679 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0303 1.9666 2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3269 3.7807 3.6916 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 13 14 1 0 12 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 8 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 27 29 1 0 29 30 1 0 29 31 1 0 31 32 1 0 21 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 19 10 1 0 31 23 1 0 1 37 1 0 1 38 1 0 1 39 1 0 4 40 1 0 5 41 1 1 6 42 1 0 8 43 1 1 10 44 1 1 12 45 1 1 13 46 1 0 13 47 1 0 14 48 1 0 15 49 1 6 16 50 1 0 17 51 1 1 18 52 1 0 19 53 1 6 20 54 1 0 21 55 1 6 23 56 1 6 25 57 1 6 26 58 1 0 26 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 6 34 68 1 0 35 69 1 0 35 70 1 0 36 71 1 0 M END