HMDB0028958 RDKit 3D Lysylphenylalanine 44 44 0 0 0 0 0 0 0 0999 V2000 5.6497 1.8875 -0.7611 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9783 1.0515 -1.7429 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 -0.3835 -1.2962 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2253 -0.5580 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8001 -0.0828 -0.1478 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0893 -0.2749 1.1930 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0983 -1.6623 1.5724 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7211 0.2609 1.0201 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5782 1.4560 0.6901 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4064 -0.5526 1.2212 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7372 0.0017 1.0438 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4299 -0.7756 -0.0714 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7847 -0.2889 -0.3215 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9138 -0.8010 0.2793 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1819 -0.3142 0.0264 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3437 0.7239 -0.8587 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2367 1.2588 -1.4767 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9741 0.7529 -1.2062 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4645 -0.0940 2.3249 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9289 -0.6234 3.3491 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7409 0.3819 2.4665 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4654 1.4121 -0.3447 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9378 2.0810 0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0003 1.4764 -1.9669 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5988 1.1263 -2.6796 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9819 -0.7676 -1.2543 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4218 -0.9666 -2.0965 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2246 -1.6283 0.2718 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7563 0.0002 0.7901 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -0.7207 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7321 0.9683 -0.4586 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6162 0.3111 1.9908 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9022 -1.8799 2.2283 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2082 -2.2600 0.7076 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -1.5590 1.4978 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 1.0673 0.7552 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3937 -1.8626 0.1458 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8067 -0.6085 -0.9897 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8245 -1.6319 0.9863 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0356 -0.7565 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3306 1.1002 -1.0533 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3646 2.0731 -2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1026 1.1737 -1.6925 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2308 0.4878 3.3234 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 6 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 11 19 1 0 19 20 2 0 19 21 1 0 18 13 1 0 1 22 1 0 1 23 1 0 2 24 1 0 2 25 1 0 3 26 1 0 3 27 1 0 4 28 1 0 4 29 1 0 5 30 1 0 5 31 1 0 6 32 1 1 7 33 1 0 7 34 1 0 10 35 1 0 11 36 1 6 12 37 1 0 12 38 1 0 14 39 1 0 15 40 1 0 16 41 1 0 17 42 1 0 18 43 1 0 21 44 1 0 M END