HMDB0252594 RDKit 3D Galbeta1-3GIcNAcbeta 51 52 0 0 0 0 0 0 0 0999 V2000 -2.2974 4.0523 0.8461 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6673 2.6634 0.5429 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7272 2.4339 -0.0771 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8357 1.6010 0.9468 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1769 0.2564 0.6627 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3995 -0.5548 1.9284 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2622 0.1933 2.7357 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0742 -1.6841 1.5315 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -2.5601 0.7877 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2462 -3.6727 0.3486 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -4.6074 -0.4123 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5672 -1.9516 -0.3445 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3599 -2.6380 -0.5368 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2167 -0.4981 -0.1925 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1006 -0.3232 0.2191 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9076 0.2932 -0.7324 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8672 -0.5505 -1.2171 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1014 -0.5236 -0.7302 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0805 -0.9304 -1.8443 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3613 -0.8835 -1.2714 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6211 0.7169 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4979 0.6488 1.2692 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8189 1.9065 -0.5768 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0017 2.2205 -1.8987 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3819 1.5990 -0.2228 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6311 2.6956 -0.6598 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1821 4.1163 0.8427 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 4.7775 0.0609 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7292 4.4251 1.7951 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9557 1.8019 1.4661 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1765 0.2273 0.1301 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -0.7743 2.4472 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6687 -0.4030 3.4134 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5965 -3.0415 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6454 -4.1393 1.2888 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1394 -3.2845 -0.1822 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0296 -4.7607 -1.2537 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1554 -2.1292 -1.2752 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2313 -2.4799 0.2589 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2842 -0.0548 -1.2194 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2423 0.5128 -1.6217 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2158 -1.3488 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0862 -0.1827 -2.6619 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8789 -1.9356 -2.2199 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0735 -0.9612 -1.9315 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6852 0.9120 -0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7034 -0.2789 1.6002 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 2.7737 0.0386 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4494 1.6478 -2.4786 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3573 1.6332 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9349 3.0439 -1.5337 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 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 18 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 14 5 1 0 25 16 1 0 1 27 1 0 1 28 1 0 1 29 1 0 4 30 1 0 5 31 1 0 6 32 1 0 7 33 1 0 9 34 1 0 10 35 1 0 10 36 1 0 11 37 1 0 12 38 1 0 13 39 1 0 14 40 1 0 16 41 1 0 18 42 1 0 19 43 1 0 19 44 1 0 20 45 1 0 21 46 1 0 22 47 1 0 23 48 1 0 24 49 1 0 25 50 1 0 26 51 1 0 M END