MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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3,5-diiodo-L-tyrosine

MNXM525 is deprecated and here replaced by MNXM730786
!!! Alternative mappings exist !!!

	Properties	Image
MNX_ID	MNXM730786
reference	chebi:57506
formula	C₉H₈I₂NO₃
global charge	-1
mol weight	431.975
InChIKey	NYPYHUZRZVSYKL-ZETCQYMHSA-M
InChI	InChI=1S/C9H9I2NO3/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,7,13H,3,12H2,(H,14,15)/p-1/t7-/m0/s1
SMILES	[NH3+][C@@H](CC1=CC(I)=C([O-])C(I)=C1)C(=O)[O-]

MNX internals

InChI (mnx)	InChI=1/C9H9I2NO3/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,7,13H,3,12H2,(H,14,15)/t7-/m0/s1
SMILES (mnx)	[CH:1]1=[C:4]([CH2:3][C@@H:7]([C:9](=[O:14])[OH:15])[NH2:12])[CH:2]=[C:6]([I:11])[C:8]([OH:13])=[C:5]1[I:10]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	9
in models (compartimentalized)	7

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-352329 reactomeM:R-ALL-352329 CHEBI:57506 chebi:57506 NYPYHUZRZVSYKL-ZETCQYMHSA-M	3,5-diiodo-L-tyrosine (2S)-2-ammonio-3-(3,5-diiodo-4-oxidophenyl)propanoate (2S)-2-azaniumyl-3-(3,5-diiodo-4-oxidophenyl)propanoate 3,5-diiodo-L-tyrosinate(1-)
bigg.metabolite:35diotyr biggM:35diotyr NYPYHUZRZVSYKL-ZETCQYMHSA-N	3,5-Diiodo-L-tyrosine
hmdb:HMDB0003474 NYPYHUZRZVSYKL-ZETCQYMHSA-N	3,5-Diiodo-L-tyrosine (2S)-2-Amino-3-(4-hydroxy-3,5-diiodophenyl)propanoate (2S)-2-Amino-3-(4-hydroxy-3,5-diiodophenyl)propanoic acid 3,5-Diiodotyrocine 3,5-Diiodotyrosine 3,5-Iodo-L-tyrosine 3,5-L-Diiodotyrosine 4-Hydroxy-3,5-diiodophenylalanine Acid, iodogorgoic DIT DiIY Diiodotyrosine Iodogorgoic acid L-3,5-Diiodotyrosine L-Diiodotyrosine
kegg.compound:C01060 keggC:C01060 NYPYHUZRZVSYKL-ZETCQYMHSA-N	3,5-Diiodo-L-tyrosine 3,5-Diiodotyrosine L-Diiodotyrosine
vmhM:35diotyr vmhmetabolite:35diotyr NYPYHUZRZVSYKL-ZETCQYMHSA-N	3,5-diiodo-L-tyrosine (2S)-2-amino-3-(4-hydroxy-3,5-diiodophenyl)propanoic acid
CHEBI:15768 chebi:15768 NYPYHUZRZVSYKL-ZETCQYMHSA-N	3,5-diiodo-L-tyrosine (2S)-2-amino-3-(4-hydroxy-3,5-diiodophenyl)propanoic acid 3,5-DIIODOTYROSINE 3,5-Diiodo-L-tyrosine 3,5-Diiodotyrosine DIT DiIY L-3,5-diiodotyrosine L-Diiodotyrosine diiodotyrosine
metacyc.compound:DIIODO-L-TYROSINE metacycM:DIIODO-L-TYROSINE NYPYHUZRZVSYKL-ZETCQYMHSA-M	3,5-diiodo-L-tyrosine 3,5-diiodotyrosine diiodo-L-tyrosine diiodotyrosine iodotyrosine
kegg.drug:D03850 keggD:D03850 NYPYHUZRZVSYKL-ZETCQYMHSA-N	Diotyrosine I 125 (USAN)
kegg.drug:D03857 keggD:D03857 NYPYHUZRZVSYKL-ZETCQYMHSA-N	Diotyrosine I 131 (USAN)
seed.compound:cpd00779 seedM:cpd00779 NYPYHUZRZVSYKL-ZETCQYMHSA-N	L-Diiodotyrosine 3,5-Diiodo-L-tyrosine 3,5-Diiodotyrosine 3,5-diiodo-L-tyrosine 3,5-diiodotyrosine diiodo-L-tyrosine diiodotyrosine
envipath:...90ef6f60917d envipathM:...90ef6f60917d NYPYHUZRZVSYKL-ZETCQYMHSA-M	compound 0042211
hmdb:HMDB03474 chebi:11710 chebi:1405 chebi:19909 chebi:46196 biggM:M_35diotyr keggC:M_C01060 keggD:M_D03850 keggD:M_D03857 seedM:M_cpd00779 vmhM:M_35diotyr	secondary/obsolete/fantasy identifier