3-Bromo-L-tyrosine -molcms-05182603182D 24 24 0 0 1 0 0 0 0 0999 V2000 3.4641 0.0000 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7321 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7321 -3.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7321 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7321 1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3827 0.9239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3827 0.9239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -0.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2232 -1.2660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6321 -1.1428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4584 -2.1276 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5718 -0.8008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3378 -1.4436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5088 0.2660 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4936 0.0924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1668 1.2057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3301 -1.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 9 2 1 0 0 0 0 9 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 6 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 14 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 3 23 1 0 0 0 0 23 24 1 0 0 0 0 M END > 3-Bromo-L-tyrosine > 38739-13-8 > C9H10BrNO3 > MFCD09836116 > 260.08 > > 247-248 oC > > BrC1=C(C([H])=C([H])C(=C1[H])C([H])([H])[C@@]([H])(C(=O)O[H])N([H])[H])O[H] $$$$