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3,3'-diiodo-L-thyronine sulfate

Properties

Image

Occurences in reactions

MNX_ID

MNXM3164

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

formula

C₁₅H₁₃I₂NO₇S

charge

mass

604.85022

reference

InChIKey

NBAZIIRGURJZJA-LBPRGKRZSA-N

InChI

InChI=1S/C15H13I2NO7S/c16-10-5-8(6-12(18)15(19)20)1-3-13(10)24-9-2-4-14(11(17)7-9)25-26(21,22)23/h1-5,7,12H,6,18H2,(H,19,20)(H,21,22,23)/t12-/m0/s1

SMILES

N[C@@H](Cc1ccc(Oc2ccc(OS(=O)(=O)O)c(I)c2)c(I)c1)C(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-176519 reactomeM:R-ALL-176519 CHEBI:35431 chebi:35431	3,3'-diiodo-L-thyronine sulfate 3,3'-T2 sulfate 3,3'-T2S 3,3'-diiodothyronine-4-sulfate 3-iodo-O-[3-iodo-4-(sulfooxy)phenyl]-L-tyrosine
bigg.metabolite:CE2870 biggM:CE2870	3,3'-diiodo-L-thyronine 4'-O-sulfate
CHEBI:176515 chebi:176515	3,3'-diiodo-L-thyronine sulfate 3,3'-diiodo-L-thyronine sulfate(1-)
biggM:M_CE2870	secondary/obsolete/fantasy identifier