HMDB0028758 RDKit 3D Aspartyl-Lysine 37 36 0 0 0 0 0 0 0 0999 V2000 -5.4521 -0.0032 0.8253 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8538 -0.1152 -0.4964 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4779 0.5639 -0.5134 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6372 -0.1428 0.5057 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 0.3735 0.6391 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3962 0.3264 -0.5647 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9028 0.8685 -0.2456 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9459 0.1412 0.4178 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7469 -1.0360 0.7618 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2558 0.7564 0.7042 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1978 2.1365 0.2512 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4351 0.0955 0.0925 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6929 -1.2918 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0559 -1.9619 1.3126 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7638 -1.9746 -0.1326 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3198 -0.9897 -1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7768 -1.5073 -1.5304 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4729 -1.6808 -1.5732 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4859 -0.1400 0.7451 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1211 -0.7877 1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5214 0.2828 -1.2614 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7475 -1.2142 -0.6929 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1111 0.5255 -1.5341 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6763 1.6210 -0.2491 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1431 0.0446 1.5006 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6456 -1.2258 0.3833 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2742 1.4277 0.9943 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7713 -0.1939 1.4807 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7961 1.0163 -1.3697 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1608 1.8735 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4247 0.7657 1.8201 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7524 2.7746 0.9198 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0873 2.4657 -0.1614 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4555 0.2144 -1.0217 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3388 0.6837 0.4456 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6421 -2.0261 0.3651 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4762 -2.6665 -1.7083 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 6 16 1 0 16 17 2 0 16 18 1 0 1 19 1 0 1 20 1 0 2 21 1 0 2 22 1 0 3 23 1 0 3 24 1 0 4 25 1 0 4 26 1 0 5 27 1 0 5 28 1 0 6 29 1 0 7 30 1 0 10 31 1 0 11 32 1 0 11 33 1 0 12 34 1 0 12 35 1 0 15 36 1 0 18 37 1 0 M END