HMDB0248253 RDKit 3D alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-D-GlcNAc 72 74 0 0 0 0 0 0 0 0999 V2000 -7.8184 2.4334 -1.5253 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7950 2.1049 -0.5083 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5486 2.8594 0.4555 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0730 0.8968 -0.6337 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0448 0.5213 0.3488 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4962 -0.7198 1.0295 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2141 -0.6973 2.4172 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0275 -1.8862 0.4513 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6717 -2.0076 0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2763 -2.8671 -0.7448 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6695 -2.3583 -1.9605 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9276 -0.6664 0.4159 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6331 -0.8783 0.1614 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6582 -0.7547 1.0803 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0498 -1.9217 1.2741 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9978 -1.8920 2.2533 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9632 -3.0383 2.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5788 -2.9215 0.7588 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7185 -0.5795 2.3902 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2669 0.1688 3.4751 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 0.2174 1.0991 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4552 -0.3696 0.1276 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5294 0.4017 -0.3101 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4298 0.7644 -1.6292 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4673 1.6790 -1.9008 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1968 2.5315 -3.0934 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2789 3.3862 -3.2583 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7789 0.9182 -2.0158 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8648 1.6604 -1.5696 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6689 -0.4087 -1.2679 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9589 -0.8014 -0.9462 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8466 -0.2237 -0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5425 0.5739 0.8958 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2746 0.3231 0.5845 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2451 1.5899 0.9227 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6850 0.3659 -0.3342 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0774 1.6095 -0.2145 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8544 3.5479 -1.5986 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5333 2.0790 -2.5503 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7978 2.0242 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2876 0.2748 -1.4425 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 1.3389 1.0958 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6027 -0.7580 0.9729 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5241 0.1323 2.8079 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3316 -2.5408 1.3357 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7859 -3.8442 -0.6079 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1756 -3.1022 -0.7122 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9557 -2.3347 -2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9827 -0.3491 1.4992 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0554 -0.4379 2.0588 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5113 -2.1042 3.2253 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4237 -4.0056 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -3.1095 2.7981 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8812 -3.8368 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7841 -0.8186 2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7861 0.9850 3.5365 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0407 1.2251 1.3616 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4488 1.3491 0.2924 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5457 2.3236 -1.0038 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2966 3.1225 -2.9466 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1037 1.8965 -4.0031 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2154 4.1480 -2.6166 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9452 0.6719 -3.0788 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6701 1.3642 -2.0965 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2225 -1.1426 -1.9426 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9700 -1.6740 -0.4725 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7574 -1.2384 0.4457 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3957 0.1447 1.1502 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 0.2944 -0.5397 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 2.2659 0.4846 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9105 0.0962 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2429 1.9991 0.6844 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 1 0 9 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 1 0 16 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 25 28 1 0 28 29 1 0 28 30 1 0 30 31 1 0 30 32 1 0 32 33 1 0 21 34 1 0 34 35 1 0 12 36 1 0 36 37 1 0 36 5 1 0 34 14 1 0 32 23 1 0 1 38 1 0 1 39 1 0 1 40 1 0 4 41 1 0 5 42 1 0 6 43 1 0 7 44 1 0 9 45 1 0 10 46 1 0 10 47 1 0 11 48 1 0 12 49 1 0 14 50 1 0 16 51 1 0 17 52 1 0 17 53 1 0 18 54 1 0 19 55 1 0 20 56 1 0 21 57 1 0 23 58 1 0 25 59 1 0 26 60 1 0 26 61 1 0 27 62 1 0 28 63 1 0 29 64 1 0 30 65 1 0 31 66 1 0 32 67 1 0 33 68 1 0 34 69 1 0 35 70 1 0 36 71 1 0 37 72 1 0 M END