HMDB0248586 RDKit 3D Arginyl-glycyl-aspartyl-phenylalanine 66 66 0 0 0 0 0 0 0 0999 V2000 -9.5298 1.6493 1.4803 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1909 1.5034 1.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7781 2.0105 3.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3434 0.9181 1.1151 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7379 0.3958 -0.1505 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6616 -0.1423 -1.0238 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9257 -1.2770 -0.4366 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1769 -0.9461 0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5019 -2.2002 1.2296 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0754 0.0002 0.4986 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3491 1.2047 0.3249 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7292 -0.4330 0.3908 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6845 0.4932 0.0914 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3505 -0.2224 -0.0077 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4376 -1.4697 0.1744 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7788 0.5261 -0.2781 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1092 0.0425 -0.4417 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -1.4802 -0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4984 -2.1492 -1.4638 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -1.4731 -2.4131 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3259 -3.5210 -1.5015 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0373 0.7250 0.4514 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6721 1.6315 1.2756 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4075 0.3892 0.4252 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3759 1.0294 1.2912 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2572 1.8842 0.3873 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9274 1.0073 -0.6248 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1526 0.4359 -0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7906 -0.3698 -1.2758 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1797 -0.6045 -2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9491 -0.0455 -2.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3366 0.7570 -1.8402 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1702 0.0548 2.0469 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0039 -1.1862 1.9406 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1604 0.4846 2.9285 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7785 1.8619 0.4976 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2983 1.5494 2.1699 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8293 1.8528 3.5396 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4280 2.5839 3.7189 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5773 -0.3467 -0.0172 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2704 1.2514 -0.6827 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1091 -0.4619 -2.0105 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9277 0.6797 -1.2945 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6877 -2.0646 -0.1509 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2202 -1.7642 -1.1582 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7550 -0.5470 1.6361 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1721 -2.9475 1.4422 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8249 -1.9900 2.0027 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 -1.4404 0.5348 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8907 0.9765 -0.8926 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5454 1.2984 0.8284 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6347 1.5820 -0.3737 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3458 0.2611 -1.5533 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2871 -1.7843 -0.3684 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8206 -1.7953 0.6158 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0147 -4.1942 -1.2016 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7554 -0.3472 -0.2361 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8527 1.7347 1.9621 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5985 2.5939 -0.1378 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9769 2.4560 0.9917 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6352 0.6232 0.5878 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7663 -0.8242 -1.0621 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6864 -1.2352 -3.1916 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5297 -0.2697 -3.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3766 1.1880 -2.0708 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6188 -0.1029 3.6061 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 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 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 17 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 25 33 1 0 33 34 2 0 33 35 1 0 32 27 1 0 1 36 1 0 1 37 1 0 3 38 1 0 3 39 1 0 5 40 1 0 5 41 1 0 6 42 1 0 6 43 1 0 7 44 1 0 7 45 1 0 8 46 1 0 9 47 1 0 9 48 1 0 12 49 1 0 13 50 1 0 13 51 1 0 16 52 1 0 17 53 1 0 18 54 1 0 18 55 1 0 21 56 1 0 24 57 1 0 25 58 1 0 26 59 1 0 26 60 1 0 28 61 1 0 29 62 1 0 30 63 1 0 31 64 1 0 32 65 1 0 35 66 1 0 M END