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3'-monoiodo-L-thyronine 4'-O-sulfate

Properties

Image

Occurences in reactions

MNX_ID

MNXM150752

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

formula

C₁₅H₁₃INO₇S

charge

-1

mass

477.94629

reference

InChIKey

HPQMRLCNKPMUJD-CYBMUJFWSA-M

InChI

InChI=1S/C15H14INO7S/c16-12-8-11(5-6-14(12)24-25(20,21)22)23-10-3-1-9(2-4-10)7-13(17)15(18)19/h1-6,8,13H,7,17H2,(H,18,19)(H,20,21,22)/p-1/t13-/m1/s1

SMILES

[NH3+][C@H](Cc1ccc(Oc2ccc(OS(=O)(=O)[O-])c(I)c2)cc1)C(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
bigg.metabolite:CE2875 biggM:CE2875	3'-monoiodo-L-thyronine 4'-O-sulfate
hmdb:HMDB0060076	3'-Monoiodo-L-thyronine 4'-O-sulfate (2R)-2-amino-3-{4-[3-iodo-4-(sulfooxy)phenoxy]phenyl}propanoic acid 3'-Monoiodo-L-thyronine 4'-O-sulfuric acid 3'-Monoiodo-L-thyronine 4'-O-sulphate 3'-Monoiodo-L-thyronine 4'-O-sulphuric acid
hmdb:HMDB60076 biggM:M_CE2875	secondary/obsolete/fantasy identifier