HMDB0004987 RDKit 3D Aspartyllysine 37 36 0 0 0 0 0 0 0 0999 V2000 -4.6568 2.4705 0.8769 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6007 2.0073 0.0034 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0868 0.7013 0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9631 0.1453 -0.2961 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5195 -1.1455 0.3481 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3975 -1.8043 -0.4260 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7294 -0.8806 -0.4639 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9684 -1.2360 0.1234 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0909 -2.3640 0.6829 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0897 -0.2729 0.0654 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6750 0.9155 -0.6260 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4709 0.0369 1.5111 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5902 0.9971 1.5459 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0505 1.3786 2.6384 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1171 1.4641 0.3626 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8303 -2.1222 -1.8082 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2593 -1.6281 -2.8192 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8882 -2.9835 -1.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3997 3.4016 1.3111 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8399 1.8193 1.6733 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7637 2.7468 0.0162 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9592 1.8279 -1.0257 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6773 0.9227 1.5796 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9191 -0.0316 0.6272 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1348 0.9024 -0.2687 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2946 0.0005 -1.3283 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2385 -0.9342 1.3805 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4112 -1.8095 0.3817 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1059 -2.7347 0.1007 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5964 0.0364 -0.9299 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9772 -0.7494 -0.4234 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9829 1.4657 -0.1111 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4019 0.6980 -1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6687 -0.8817 2.0669 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5738 0.5206 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8066 0.9781 -0.1976 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8435 -3.8586 -2.5028 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 1 7 30 1 0 10 31 1 6 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