HMDB0028993 RDKit 3D Phenylalanylglutamine 40 40 0 0 0 0 0 0 0 0999 V2000 -6.4730 -1.7261 -0.4364 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0799 -1.6255 -0.2433 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3406 -2.6278 -0.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4119 -0.3529 0.1521 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9429 -0.5051 0.2843 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 0.7677 0.6599 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8410 0.4821 0.7534 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1293 1.0022 -0.1362 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1257 1.7624 -1.0992 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5566 0.6480 0.0486 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8006 -0.2176 1.1588 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 0.1372 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6092 -0.2059 -1.0054 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0476 -1.4467 -0.6097 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3979 -1.7041 -0.4139 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3177 -0.7102 -0.6162 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9121 0.5415 -1.0121 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5730 0.7729 -1.1993 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7873 1.4821 1.8122 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0682 1.7930 2.8288 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1029 1.8978 1.9277 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1809 -1.5428 0.3116 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8595 -1.9971 -1.3671 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9188 -0.0475 1.0909 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6193 0.3954 -0.6384 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6315 -1.3144 0.9781 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -0.8498 -0.7239 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3633 1.4556 -0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5683 -0.1467 1.5374 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0832 1.6240 0.2657 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3663 -1.1483 1.0458 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 0.2175 2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 -0.7656 -1.5531 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1268 0.9129 -2.0278 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3171 -2.2328 -0.4499 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7045 -2.6751 -0.1075 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3669 -0.9281 -0.4589 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6745 1.2908 -1.1582 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2673 1.7619 -1.5107 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2910 2.8788 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 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 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 6 19 1 0 19 20 2 0 19 21 1 0 18 13 1 0 1 22 1 0 1 23 1 0 4 24 1 0 4 25 1 0 5 26 1 0 5 27 1 0 6 28 1 6 7 29 1 0 10 30 1 1 11 31 1 0 11 32 1 0 12 33 1 0 12 34 1 0 14 35 1 0 15 36 1 0 16 37 1 0 17 38 1 0 18 39 1 0 21 40 1 0 M END