3',5'-diiodothyronamine

Properties Image MNX_ID MNXM9934 reference chebi:233342 formula C14H14I2NO2 global charge 1 mol weight 482.079 InChIKey JNKNXEJLUBMMOQ-UHFFFAOYSA-O InChI InChI=1S/C14H13I2NO2/c15-12-7-11(8-13(16)14(12)18)19-10-3-1-9(2-4-10)5-6-17/h1-4,7-8,18H,5-6,17H2/p+1 SMILES [NH3+]CCC1=CC=C(OC2=CC(I)=C(O)C(I)=C2)C=C1 MNX internals InChI (mnx) InChI=1/C14H13I2NO2/c15-12-7-11(8-13(16)14(12)18)19-10-3-1-9(2-4-10)5-6-17/h1-4,7-8,18H,5-6,17H2 SMILES (mnx) [CH:1]1=[CH:3][C:10]([O:19][C:11]2=[CH:7][C:12]([I:15])=[C:14]([OH:18])[C:13]([I:16])=[CH:8]2)=[CH:4][CH:2]=[C:9]1[CH2:5][CH2:6][NH2:17]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 2