HMDB0028990 RDKit 3D Phenylalanylasparagine 37 37 0 0 0 0 0 0 0 0999 V2000 5.6961 -1.5264 1.0856 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9621 -0.5459 0.3449 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6409 0.3004 -0.2736 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5121 -0.6304 0.3846 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7571 0.3703 -0.4283 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3323 0.0713 -0.1953 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4809 0.9783 0.4619 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9364 2.0672 0.8616 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9385 0.6604 0.6839 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6072 1.7517 1.3783 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6391 0.3139 -0.6151 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0566 -0.0070 -0.4241 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4231 -1.3094 -0.1772 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7291 -1.7211 0.0168 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6827 -0.7311 -0.0508 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3476 0.5751 -0.2952 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0373 0.9529 -0.4842 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0512 0.3389 -1.8743 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1077 0.0654 -2.6663 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2759 0.5845 -2.4452 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2377 -1.2911 1.9491 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7235 -2.5282 0.7941 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2028 -0.4532 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1322 -1.6453 0.1328 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9371 1.3756 -0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9297 -0.8372 -0.5227 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9666 -0.2026 1.3878 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9024 2.1740 2.0186 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3733 1.3509 1.9518 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4799 1.1033 -1.3773 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1283 -0.5916 -1.0071 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6781 -2.1173 -0.1187 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9629 -2.7579 0.2077 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7248 -1.0079 0.0956 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1189 1.3573 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7757 2.0098 -0.6811 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6564 1.5023 -2.6251 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 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 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 5 18 1 0 18 19 2 0 18 20 1 0 17 12 1 0 1 21 1 0 1 22 1 0 4 23 1 0 4 24 1 0 5 25 1 1 6 26 1 0 9 27 1 1 10 28 1 0 10 29 1 0 11 30 1 0 11 31 1 0 13 32 1 0 14 33 1 0 15 34 1 0 16 35 1 0 17 36 1 0 20 37 1 0 M END