HMDB0029112 RDKit 3D Tyrosyl-Phenylalanine 44 45 0 0 0 0 0 0 0 0999 V2000 2.1553 -0.9659 -1.5044 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5617 0.0266 -0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5648 0.3018 0.4491 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9107 0.6779 0.0424 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8008 -0.3709 -0.1741 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1157 -0.1442 -0.5318 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5067 1.1795 -0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8168 1.5320 -1.0309 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6206 2.2035 -0.4356 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3237 1.9551 -0.0849 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -0.5839 0.0436 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6077 -0.9939 1.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9147 -0.7533 -0.5118 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8367 -1.3977 0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 -1.8445 0.1535 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2775 -0.8907 -0.0606 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5721 -0.3019 -1.2324 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7078 0.5269 -1.3531 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5422 0.7534 -0.2955 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2128 0.1292 0.8995 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1384 -0.6638 1.0475 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0473 -0.0542 1.2849 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5196 0.1423 2.2962 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 0.7947 0.6103 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8838 -0.9659 -2.4625 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2035 -1.8804 -1.0557 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3167 0.9095 -1.2337 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0969 1.0692 1.1421 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5899 -0.6237 1.0481 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4802 -1.3962 -0.0534 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8261 -0.9564 -0.6925 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0601 1.6751 -2.0103 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9947 3.2353 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6946 2.8378 0.0666 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1936 -0.4606 -1.4505 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2454 -2.0057 1.1474 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4984 -2.5416 1.0124 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1846 -2.5817 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9536 -0.4209 -2.1527 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8938 1.0001 -2.2974 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4213 1.4009 -0.3423 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8783 0.2886 1.7713 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8649 -1.1548 1.9532 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5179 1.3135 -0.2168 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 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 2 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 14 22 1 0 22 23 2 0 22 24 1 0 10 4 1 0 21 16 1 0 1 25 1 0 1 26 1 0 2 27 1 0 3 28 1 0 3 29 1 0 5 30 1 0 6 31 1 0 8 32 1 0 9 33 1 0 10 34 1 0 13 35 1 0 14 36 1 0 15 37 1 0 15 38 1 0 17 39 1 0 18 40 1 0 19 41 1 0 20 42 1 0 21 43 1 0 24 44 1 0 M END