HMDB0029135 RDKit 3D Valylproline 33 33 0 0 0 0 0 0 0 0999 V2000 1.9076 -0.1860 -1.9086 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4123 0.9190 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3238 2.1336 -1.2736 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5472 0.6055 0.4425 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9819 0.4015 0.6425 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8425 -0.6208 0.8493 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5685 -1.6418 1.1178 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5452 -0.7638 0.9676 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2103 -2.0127 1.3613 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5551 -2.0159 0.6668 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5526 -0.7111 -0.1326 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6595 0.1401 0.7838 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3423 0.4859 2.0307 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9769 0.0429 3.1324 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4336 1.3353 1.9881 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1885 -0.3106 -2.7626 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9087 0.0378 -2.3399 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9399 -1.1735 -1.4091 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4049 1.2662 -1.2638 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0914 2.8414 -0.4528 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3597 1.7916 -1.1087 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1712 2.5531 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2432 1.5088 0.9962 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3989 -0.1927 -0.0805 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 1.2697 0.8615 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3751 -2.0960 2.4345 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5844 -2.8628 1.0054 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 -2.0566 1.3646 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5658 -2.8359 -0.0881 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5725 -0.2994 -0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1172 -0.8222 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4269 1.0350 0.1971 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4463 2.2345 1.5353 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 1 0 12 13 1 0 13 14 2 0 13 15 1 0 12 8 1 0 1 16 1 0 1 17 1 0 1 18 1 0 2 19 1 0 3 20 1 0 3 21 1 0 3 22 1 0 4 23 1 1 5 24 1 0 5 25 1 0 9 26 1 0 9 27 1 0 10 28 1 0 10 29 1 0 11 30 1 0 11 31 1 0 12 32 1 6 15 33 1 0 M END