HMDB0028735 RDKit 3D Asparaginyl-Leucine 36 35 0 0 0 0 0 0 0 0999 V2000 -3.1697 1.8192 -1.2178 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5567 0.4791 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5335 -0.5083 -0.6473 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1878 0.2710 -0.8425 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8297 0.4731 0.5694 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6286 0.1600 0.6305 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -0.9758 1.3342 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -1.7651 1.9361 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5428 -1.2547 1.3744 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7356 -2.4256 2.2511 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1177 -1.6723 0.0417 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9602 -0.6678 -1.0268 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8644 0.4495 -1.1251 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0262 -0.7973 -1.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9689 1.7785 1.1774 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0557 2.4652 1.5479 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1762 2.4275 1.4318 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4393 2.6732 -1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 1.9154 -0.4719 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7224 2.0210 -2.2002 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6184 0.1439 -2.4143 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4421 -0.5307 -1.2729 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0523 -1.5107 -0.5182 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7713 -0.0555 0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9329 -0.8190 -1.0668 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 0.8126 -1.5406 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -0.2815 1.2061 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2375 0.8359 0.1327 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1055 -0.3828 1.7802 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4395 -3.2489 1.6475 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0625 -2.3940 3.0564 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2152 -1.8218 0.2089 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7359 -2.6745 -0.2486 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0682 0.9970 -0.2663 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2609 0.6353 -2.0713 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2628 3.4289 1.5038 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 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 1 0 12 14 2 0 5 15 1 0 15 16 2 0 15 17 1 0 1 18 1 0 1 19 1 0 1 20 1 0 2 21 1 0 3 22 1 0 3 23 1 0 3 24 1 0 4 25 1 0 4 26 1 0 5 27 1 0 6 28 1 0 9 29 1 0 10 30 1 0 10 31 1 0 11 32 1 0 11 33 1 0 13 34 1 0 13 35 1 0 17 36 1 0 M END