HMDB0246661 RDKit 3D O-(4-Hydroxy-3,5-diiodophenyl)-L-tyrosine 35 36 0 0 0 0 0 0 0 0999 V2000 -3.3445 1.3913 0.1176 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.4533 0.8080 1.4337 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1997 -0.6809 1.4369 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8237 -0.9875 0.9335 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7426 -1.0614 1.7821 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5367 -1.3410 1.3534 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7159 -1.5531 0.0032 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9846 -1.8364 -0.4676 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8773 -0.8565 -0.8776 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7457 -0.2990 0.0239 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6331 0.6843 -0.4138 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9816 1.5567 0.9635 I 0 0 0 0 0 0 0 0 0 0 0 0 4.6103 1.0674 -1.7445 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4892 2.0456 -2.1923 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7276 0.4923 -2.6331 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7027 1.0885 -4.6697 I 0 0 0 0 0 0 0 0 0 0 0 0 2.8449 -0.4810 -2.2138 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 -1.4867 -0.8835 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6266 -1.2009 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8122 1.0400 1.9626 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7127 1.4310 1.1893 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1199 0.8370 3.2926 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.8226 2.3180 0.1089 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7893 0.8127 -0.6213 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3352 1.4833 -0.1458 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7238 1.2567 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8998 -1.2429 0.8197 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2534 -1.0256 2.4757 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.8887 2.8302 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3811 -1.3929 2.0588 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7668 -0.5979 1.0732 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4926 2.3402 -3.1498 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1579 -0.9264 -2.9128 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2307 -1.6504 -1.9488 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -1.1439 -1.0797 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 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 11 13 2 0 13 14 1 0 13 15 1 0 15 16 1 0 15 17 2 0 7 18 1 0 18 19 2 0 2 20 1 0 20 21 2 0 20 22 1 0 19 4 1 0 17 9 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 3 27 1 0 3 28 1 0 5 29 1 0 6 30 1 0 10 31 1 0 14 32 1 0 17 33 1 0 18 34 1 0 19 35 1 0 M CHG 2 1 1 22 -1 M END