HMDB0006583 RDKit 3D Poly-N-acetyllactosamine 51 51 0 0 0 0 0 0 0 0999 V2000 1.8978 0.9119 -4.2315 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5696 0.7413 -2.9271 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8216 0.6954 -2.8989 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8571 0.6277 -1.7083 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5178 0.4627 -0.4504 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3670 1.6025 0.4646 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7604 2.5911 0.1261 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3142 -0.8849 0.1442 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9555 -1.0059 1.3573 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9177 -1.4268 0.1380 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1768 -0.8531 1.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9139 -0.0934 0.7597 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7809 1.2455 1.1288 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4924 2.0321 0.2187 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5331 3.4698 0.6058 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2532 4.1921 -0.3439 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9102 1.5177 0.0673 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7778 2.5934 0.2134 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2339 0.5436 1.1960 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3298 1.2547 2.3894 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2298 -0.5817 1.2946 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7035 -1.7171 0.6309 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9884 -2.9394 0.1995 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3023 -3.4872 0.0535 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5799 -3.4111 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5993 -4.8413 1.5232 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8068 1.0517 -4.1356 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3814 1.7855 -4.7368 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1183 0.0127 -4.8364 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8106 0.6670 -1.7201 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6456 0.4766 -0.7056 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7997 1.5579 1.4446 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8947 -1.5960 -0.5407 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -0.8470 1.1928 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5017 -1.1620 -0.8953 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9867 -0.1018 -0.3468 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9901 1.9311 -0.7606 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5485 3.9062 0.8359 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1285 3.5654 1.5597 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2341 3.7805 -1.2305 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1032 1.0787 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7276 2.3119 0.3249 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2518 0.1182 0.9512 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9006 0.7571 3.0399 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1188 -0.7928 2.3964 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5678 -2.4836 1.2435 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6002 -3.3654 -0.6129 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1713 -4.4650 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6538 -3.1616 1.6224 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9872 -3.0703 2.3683 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7408 -5.1949 1.8708 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 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 14 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 10 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 21 12 1 0 1 27 1 0 1 28 1 0 1 29 1 0 4 30 1 0 5 31 1 6 6 32 1 0 8 33 1 6 9 34 1 0 10 35 1 6 12 36 1 6 14 37 1 6 15 38 1 0 15 39 1 0 16 40 1 0 17 41 1 6 18 42 1 0 19 43 1 6 20 44 1 0 21 45 1 1 22 46 1 0 23 47 1 6 24 48 1 0 25 49 1 0 25 50 1 0 26 51 1 0 M END