HMDB0001542 RDKit 3D N-Acetyllactosamine 51 52 0 0 0 0 0 0 0 0999 V2000 4.7343 3.0595 2.5956 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0306 2.2756 1.5768 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0576 2.7089 0.3752 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3224 1.0633 1.8548 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 0.3470 0.8200 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2159 -1.0383 0.5974 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5568 -0.8787 0.2497 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5869 -1.6355 -0.4887 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2025 -1.6698 -0.3392 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5946 -2.5324 -1.3907 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1352 -3.8285 -1.2451 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6178 -0.2720 -0.3008 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7212 -0.3510 -0.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3342 0.2865 -1.4309 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0727 1.3381 -0.9142 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2604 1.0349 -0.3294 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0598 0.3950 1.0177 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3682 1.2136 1.8977 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1898 0.2023 -1.1615 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.3375 -0.1539 -0.4426 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4664 -1.0030 -1.6697 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2827 -1.9776 -0.7243 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1891 -0.5310 -2.3249 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6086 0.3317 -3.3701 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1336 0.3204 1.0090 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7121 1.6042 1.2133 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7786 4.1408 2.2751 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1951 3.0686 3.5672 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8056 2.7495 2.7106 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 0.7203 2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8008 0.8920 -0.1598 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1843 -1.6647 1.5054 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 -0.1892 0.8647 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9269 -2.1294 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5095 -2.5817 -1.1565 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7968 -2.1044 -2.3849 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5795 -3.9233 -0.3548 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1228 0.3020 -1.1034 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5082 0.7691 -2.0291 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7613 2.0305 -0.1115 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0864 0.1670 1.4375 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5556 -0.5857 0.9948 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7229 0.6988 2.4613 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5520 0.8409 -1.9993 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9716 -0.5341 -1.0846 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0969 -1.3986 -2.5228 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4468 -2.9003 -1.0773 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6911 -1.3614 -2.8371 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4775 1.2706 -3.1459 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8358 -0.3468 1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 1.7597 2.1479 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 21 23 1 0 23 24 1 0 12 25 1 0 25 26 1 0 25 5 1 0 23 14 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 1 7 33 1 0 9 34 1 1 10 35 1 0 10 36 1 0 11 37 1 0 12 38 1 6 14 39 1 6 16 40 1 1 17 41 1 0 17 42 1 0 18 43 1 0 19 44 1 6 20 45 1 0 21 46 1 6 22 47 1 0 23 48 1 6 24 49 1 0 25 50 1 1 26 51 1 0 M END