HMDB0028980 RDKit 3D Methionyl-Phenylalanine 40 40 0 0 0 0 0 0 0 0999 V2000 5.1116 -0.7763 2.7157 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4025 -0.0859 1.0723 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4929 -1.0513 -0.1659 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 -0.8285 0.1131 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2505 -1.6404 -0.9237 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5651 -3.0467 -0.8310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7993 -1.3993 -0.8847 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0297 -2.3869 -0.7836 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3241 -0.0648 -0.9627 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1088 0.1736 -0.9251 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3601 0.9642 0.3449 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8034 1.2673 0.4789 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3401 2.4424 -0.0142 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6859 2.6973 0.1193 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5024 1.7712 0.7506 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0033 0.5893 1.2547 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6423 0.3664 1.1019 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4637 0.9026 -2.1546 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6059 1.2447 -3.0156 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7798 1.2497 -2.4252 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4709 -1.6738 2.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1121 -1.0568 3.1252 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 -0.0222 3.3922 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7344 -0.6879 -1.1857 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6617 -2.1390 -0.0326 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7493 -1.0699 1.1413 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7628 0.2489 -0.0928 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6688 -1.3034 -1.9182 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4992 -3.5256 -1.7731 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9003 -3.5793 -0.2197 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9463 0.7637 -1.0459 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6604 -0.8070 -0.8455 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 0.3582 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7676 1.8801 0.3909 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7208 3.1969 -0.5147 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0741 3.6342 -0.2816 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5733 1.9994 0.8441 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6619 -0.1222 1.7452 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2309 -0.5703 1.4985 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0451 2.0869 -2.9169 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 5 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 10 18 1 0 18 19 2 0 18 20 1 0 17 12 1 0 1 21 1 0 1 22 1 0 1 23 1 0 3 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 5 28 1 0 6 29 1 0 6 30 1 0 9 31 1 0 10 32 1 0 11 33 1 0 11 34 1 0 13 35 1 0 14 36 1 0 15 37 1 0 16 38 1 0 17 39 1 0 20 40 1 0 M END