HMDB0028957 RDKit 3D Lysylmethionine 41 40 0 0 0 0 0 0 0 0999 V2000 4.6062 2.4818 -2.1506 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 1.8046 -0.5133 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1087 0.4597 -0.5129 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9908 -0.0138 0.9181 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9931 -1.1360 1.0817 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6650 -0.7595 0.6758 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0564 -1.4037 -0.3616 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5358 -2.3662 -0.9456 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4192 -1.0051 -0.7663 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8877 -1.8636 -1.8640 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3987 -1.0623 0.3723 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7808 -0.6557 -0.0466 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8264 0.7294 -0.5682 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4243 1.8201 0.3529 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0875 1.7762 0.8561 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0275 -1.5492 2.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9654 -1.5304 3.1655 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -1.9543 3.1189 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7120 2.6701 -2.2732 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1492 3.5052 -2.2295 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2803 1.8349 -2.9701 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5269 -0.3309 -1.1684 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1743 0.8136 -0.9427 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9872 -0.4013 1.2131 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7607 0.8297 1.5977 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2933 -1.9930 0.4308 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 0.0304 1.1671 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3943 0.0080 -1.1681 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6398 -1.3786 -2.3632 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1909 -2.7873 -1.5386 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9961 -0.5132 1.2199 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4627 -2.1518 0.6946 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5101 -0.8546 0.7683 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0587 -1.3500 -0.8936 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 0.8085 -1.5207 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 0.9740 -0.9324 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1130 1.9448 1.2159 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 2.7838 -0.2202 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3778 2.0661 0.1452 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0211 2.4607 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7391 -2.7410 2.8102 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 2 0 7 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 5 16 1 0 16 17 2 0 16 18 1 0 1 19 1 0 1 20 1 0 1 21 1 0 3 22 1 0 3 23 1 0 4 24 1 0 4 25 1 0 5 26 1 6 6 27 1 0 9 28 1 6 10 29 1 0 10 30 1 0 11 31 1 0 11 32 1 0 12 33 1 0 12 34 1 0 13 35 1 0 13 36 1 0 14 37 1 0 14 38 1 0 15 39 1 0 15 40 1 0 18 41 1 0 M END