HMDB0304776 RDKit 3D Alanyl-Tyrosine 34 34 0 0 0 0 0 0 0 0999 V2000 -4.5099 1.1258 0.4363 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8882 -0.2280 0.2218 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9529 -0.5305 -1.1964 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4926 -0.2959 0.7233 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2449 -0.0614 2.0553 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5655 -0.5704 -0.1008 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1597 -0.6673 0.2606 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5512 0.4522 -0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9926 0.5054 -0.2069 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8911 -0.1680 -0.9953 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 -0.0959 -0.7283 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7366 0.6429 0.3239 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1148 0.6998 0.5742 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8314 1.3196 1.1158 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4642 1.2515 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3425 -2.0032 -0.0737 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5316 -2.3509 0.1435 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4868 -2.9548 -0.6529 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3521 1.0084 1.1335 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9308 1.5517 -0.5079 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7282 1.8258 0.7831 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4501 -1.0309 0.7511 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 0.0180 -1.7472 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7770 -1.5727 -1.3195 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8363 0.5047 2.6582 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0901 -0.5386 1.3607 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0717 1.4028 -0.0906 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3213 0.4053 -1.5412 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5726 -0.7784 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9412 -0.6410 -1.3699 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4412 1.2474 1.3489 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1947 1.9004 1.9397 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8311 1.8135 1.5246 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3556 -3.1873 -0.1621 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 4 6 2 3 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 12 14 1 0 14 15 2 0 7 16 1 0 16 17 2 0 16 18 1 0 15 9 1 0 1 19 1 0 1 20 1 0 1 21 1 0 2 22 1 0 3 23 1 0 3 24 1 0 5 25 1 0 7 26 1 0 8 27 1 0 8 28 1 0 10 29 1 0 11 30 1 0 13 31 1 0 14 32 1 0 15 33 1 0 18 34 1 0 M END