HMDB0029134 RDKit 3D Valylphenylalanine 39 39 0 0 0 0 0 0 0 0999 V2000 -3.6709 2.1756 -0.8287 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7402 0.9179 -0.0322 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1554 0.5345 0.2502 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0357 -0.2519 -0.6832 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1969 -1.3779 0.2094 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5919 -0.0066 -0.8481 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2571 0.9426 -1.5971 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6374 -0.8111 -0.1872 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -0.5946 -0.3292 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4450 -0.2376 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9002 -0.0139 0.8539 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3694 1.2487 0.5341 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6983 1.5189 0.4307 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6156 0.5233 0.6463 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1751 -0.7435 0.9663 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8252 -1.0035 1.0679 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -1.7700 -0.9982 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6863 -2.7692 -1.3313 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7206 -1.8183 -1.2893 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4331 2.0265 -1.8979 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9310 2.8874 -0.4124 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6563 2.6880 -0.7717 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2128 1.1012 0.9373 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4322 0.8922 1.2736 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8875 0.9277 -0.4633 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2233 -0.5739 0.2998 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5089 -0.5233 -1.6565 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7097 -2.2021 -0.1996 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7346 -1.1296 1.1089 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8813 -1.6069 0.4414 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9446 0.2826 -1.0263 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2633 -1.0676 1.7111 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0222 0.6748 1.4301 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6454 2.0585 0.3582 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9989 2.5318 0.1763 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6756 0.7639 0.5577 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9359 -1.4979 1.1278 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5168 -2.0105 1.3234 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2759 -2.6862 -1.2772 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 4 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 9 17 1 0 17 18 2 0 17 19 1 0 16 11 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 0 3 24 1 0 3 25 1 0 3 26 1 0 4 27 1 6 5 28 1 0 5 29 1 0 8 30 1 0 9 31 1 6 10 32 1 0 10 33 1 0 12 34 1 0 13 35 1 0 14 36 1 0 15 37 1 0 16 38 1 0 19 39 1 0 M END