Levothroid -molcms-05142617582D 26 25 0 0 1 0 0 0 0 0999 V2000 4.3301 4.0000 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 4.3301 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3301 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7321 1.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7321 2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0622 1.0000 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 6.0622 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9282 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6603 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6603 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9282 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0000 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 9.5263 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5263 3.0000 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.0000 0.0000 Na 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 6.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 2 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 9 13 1 1 0 0 0 4 14 1 0 0 0 0 3 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 16 2 0 0 0 0 20 22 1 0 0 0 0 19 23 1 0 0 0 0 18 24 1 0 0 0 0 M CHG 2 12 -1 25 1 M END > Levothroid > 31178-59-3 > C15H12I4NNaO5 > > 816.87 > > > > IC1C(=C(C=C(C=1)C[C@@H](C(=O)[O-])N)I)OC1C=C(C(=C(C=1)I)O)I.[Na+].O $$$$