HMDB0253023 RDKit 3D H-Leu-val-OH 38 37 0 0 0 0 0 0 0 0999 V2000 4.3980 0.4205 -0.1787 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5841 -0.7990 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2509 -2.0729 -0.3862 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2248 -0.6474 -0.4914 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4251 0.5132 0.0226 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1021 1.7250 -0.2577 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0584 0.4111 -0.5398 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0812 -0.0565 -1.7141 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0992 0.8003 0.1507 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4261 0.6588 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9674 2.0415 -0.5132 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1175 3.0351 -0.5534 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2724 2.4217 -0.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2954 -0.2269 0.3395 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6389 -0.4536 -0.2735 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 -1.5864 0.6097 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4929 0.2117 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1602 0.9213 -1.1316 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2076 1.1651 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4483 -0.9426 1.2029 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9225 -2.4948 0.3608 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4142 -2.8128 -0.5157 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7413 -1.9492 -1.3516 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6675 -1.6177 -0.3357 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3727 -0.5900 -1.6054 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3862 0.3981 1.1443 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7896 2.2102 -1.1299 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 2.3888 0.5547 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0489 1.1919 1.1135 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3409 0.2706 -1.4885 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7728 2.7530 0.3164 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4678 0.2444 1.3398 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4596 -1.1977 -1.1083 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3310 -0.9186 0.4702 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0497 0.4486 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4619 -2.1948 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4791 -2.1198 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8107 -1.5504 1.2728 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 5 6 1 0 5 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 10 14 1 0 14 15 1 0 14 16 1 0 1 17 1 0 1 18 1 0 1 19 1 0 2 20 1 0 3 21 1 0 3 22 1 0 3 23 1 0 4 24 1 0 4 25 1 0 5 26 1 0 6 27 1 0 6 28 1 0 9 29 1 0 10 30 1 0 13 31 1 0 14 32 1 0 15 33 1 0 15 34 1 0 15 35 1 0 16 36 1 0 16 37 1 0 16 38 1 0 M END