HMDB0003036 RDKit 3D Triiodothyronine sulfate 39 40 0 0 0 0 0 0 0 0999 V2000 5.3561 -0.6843 0.4562 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0688 -0.6733 -0.9529 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7545 -1.3196 -1.2891 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6076 -0.6432 -0.6293 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1742 -1.0405 0.6226 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1129 -0.4330 1.2613 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5194 -1.1136 3.1855 I 0 0 0 0 0 0 0 0 0 0 0 0 0.4326 0.6105 0.6665 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6222 1.2177 1.2961 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9462 0.7946 1.1513 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9632 1.4494 1.8128 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2866 1.0201 1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6129 -0.0509 0.8649 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9213 -0.4878 0.7069 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8938 0.1611 -0.5548 S 0 0 0 0 0 6 0 0 0 0 0 0 -7.3705 1.5310 -0.1819 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0537 -0.7462 -0.8445 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9627 0.2957 -1.9574 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5909 -0.7016 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0755 -2.3527 -1.0270 I 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 -0.2772 0.3554 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8536 1.0209 -0.5873 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 2.6131 -1.5742 I 0 0 0 0 0 0 0 0 0 0 0 0 1.9272 0.4000 -1.2236 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1722 0.6767 -1.5434 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9487 0.8324 -2.7653 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5077 1.7628 -0.7817 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0242 -1.5853 0.8701 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4023 -0.6081 0.6161 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8609 -1.2943 -1.4453 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6244 -1.2329 -2.3958 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 -2.4078 -1.0795 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6557 -1.8483 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7363 2.2867 2.4408 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1062 1.5208 2.1748 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2315 -0.3905 -2.6109 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4927 -0.7840 -0.1582 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2588 0.7209 -2.2076 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2397 1.7605 0.2072 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 1 0 6 8 2 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 2 0 15 18 1 0 13 19 1 0 19 20 1 0 19 21 2 0 8 22 1 0 22 23 1 0 22 24 2 0 2 25 1 0 25 26 2 0 25 27 1 0 24 4 1 0 21 10 1 0 1 28 1 0 1 29 1 0 2 30 1 6 3 31 1 0 3 32 1 0 5 33 1 0 11 34 1 0 12 35 1 0 18 36 1 0 21 37 1 0 24 38 1 0 27 39 1 0 M END