HMDB0251550 RDKit 3D 2-Hydroxy-4-carboxybutyrylhistidylprolinamide 50 51 0 0 0 0 0 0 0 0999 V2000 -4.6631 -2.2756 -1.7224 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 -1.3483 -1.7575 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8315 -1.3514 -2.7245 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3761 -0.3609 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 0.6540 -0.6288 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2010 1.4182 -1.9113 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7021 1.3163 -2.0578 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 0.4625 -0.9375 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9348 0.5571 -0.4167 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0922 1.3399 -0.9359 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5045 -0.2453 0.7344 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1643 0.2471 2.0145 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8079 1.6597 2.2959 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 2.7928 1.8788 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8103 3.8711 2.3572 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2542 3.4323 3.0713 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2353 2.0909 3.0202 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9452 -0.2018 0.9038 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7855 -1.3218 0.8067 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2784 -2.4423 0.5576 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2606 -1.2563 0.9842 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6651 0.0674 1.2529 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9697 -1.6716 -0.3069 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4484 -1.5998 -0.1124 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1265 -2.0060 -1.3774 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5066 -2.3488 -2.4128 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5201 -2.0228 -1.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0519 -2.5593 -0.8115 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0436 -2.6611 -2.5957 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3246 -0.9743 0.2594 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3157 1.3391 0.2164 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5004 0.2038 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6936 0.9073 -2.7701 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5652 2.4526 -1.8641 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2869 2.3393 -1.8674 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3507 0.8961 -2.9948 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -1.2836 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2499 0.1763 1.8812 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8876 -0.4292 2.8522 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3554 2.8755 1.2738 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9345 4.1165 3.5549 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9546 1.4926 3.4949 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3634 0.7253 1.1106 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6212 -1.9600 1.7636 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3652 0.5834 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -0.9716 -1.1423 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7129 -2.7048 -0.5986 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7809 -0.5470 0.0945 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8249 -2.2466 0.7007 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0563 -1.2270 -1.1117 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 1 0 9 10 2 0 9 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 11 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 8 4 1 0 17 13 1 0 1 28 1 0 1 29 1 0 4 30 1 0 5 31 1 0 5 32 1 0 6 33 1 0 6 34 1 0 7 35 1 0 7 36 1 0 11 37 1 0 12 38 1 0 12 39 1 0 14 40 1 0 16 41 1 0 17 42 1 0 18 43 1 0 21 44 1 0 22 45 1 0 23 46 1 0 23 47 1 0 24 48 1 0 24 49 1 0 27 50 1 0 M END