HMDB0006248 RDKit 3D gamma-Glutamylalanine 29 28 0 0 0 0 0 0 0 0999 V2000 -3.7285 0.7705 -0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9502 0.0783 0.1670 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6130 -0.2211 -0.2452 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4945 0.3678 0.3806 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6491 1.1806 1.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8714 0.0384 -0.0675 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 0.7616 0.7171 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2864 0.3660 0.1925 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4831 0.6781 -1.1791 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5255 -1.0839 0.4025 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4048 -1.5818 1.5608 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8836 -1.9426 -0.6324 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6953 -1.1376 0.5207 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1059 -2.2540 0.4271 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0142 -1.0907 0.9497 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3711 1.8164 -1.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5924 0.2200 -1.9003 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8014 0.7187 -0.6886 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9136 0.8083 1.0092 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4865 -0.8971 -1.0329 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0595 -1.0494 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9898 0.3448 -1.1458 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7457 1.8490 0.6081 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8473 0.4540 1.7778 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 0.9206 0.7907 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1019 0.0329 -1.6956 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6303 1.6815 -1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8793 -2.1755 -0.6978 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2799 -0.6866 1.8417 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 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 2 0 10 12 1 0 2 13 1 0 13 14 2 0 13 15 1 0 1 16 1 0 1 17 1 0 1 18 1 0 2 19 1 1 3 20 1 0 6 21 1 0 6 22 1 0 7 23 1 0 7 24 1 0 8 25 1 1 9 26 1 0 9 27 1 0 12 28 1 0 15 29 1 0 M END