HMDB0029042 RDKit 3D Serylisoleucine 33 32 0 0 0 0 0 0 0 0999 V2000 -3.1885 0.1032 1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9394 -0.3785 0.7989 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7436 0.1834 -0.5893 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8557 -0.1726 -1.5283 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4653 -0.4241 -1.1788 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6191 -0.0492 -0.3026 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4602 -0.9826 0.3524 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3136 -2.2370 0.2097 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5472 -0.4932 1.2330 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2861 -1.6014 1.8027 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4622 0.4741 0.5141 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3744 0.9508 1.4612 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2594 0.2323 -2.4864 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7452 0.9639 -2.6367 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1292 0.0701 -3.5445 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 1.0009 0.9526 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0251 0.4140 2.5135 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9318 -0.7318 1.4529 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8695 -1.4982 0.8009 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -0.0104 1.4088 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5822 1.2616 -0.5151 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9717 0.6712 -2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8362 -0.2769 -1.0239 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5959 -1.0668 -2.1268 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5669 -1.5236 -1.2821 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7775 0.9670 -0.1552 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0706 0.0812 2.0669 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6864 -2.4504 1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6535 -1.3746 2.7513 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 -0.0091 -0.3011 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8687 1.3199 0.1617 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9346 1.4214 2.2002 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1428 -0.7763 -4.1212 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 5 13 1 0 13 14 2 0 13 15 1 0 1 16 1 0 1 17 1 0 1 18 1 0 2 19 1 0 2 20 1 0 3 21 1 1 4 22 1 0 4 23 1 0 4 24 1 0 5 25 1 6 6 26 1 0 9 27 1 1 10 28 1 0 10 29 1 0 11 30 1 0 11 31 1 0 12 32 1 0 15 33 1 0 M END