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H-Tyr(3-I)-OH

CAT: 0607-C7043-100Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0607-C7043-100Size:100 mg
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CAS Number
70-78-0
Product Name Alternative
(S)-2-amino-3-(4-hydroxy-3-iodophenyl)propanoic acid
Field of Research
Metabolic Enzyme Protease Endogenous Metabolite
Purity
0.9992
Solubility
Insoluble in DMSO; insoluble in EtOH; ≥3.83 mg/mL in H2O with ultrasonic
Smiles
O=C([C@@](CC1=CC(I)=C(O)C=C1)([H])N)O
Molecular Formula
C9H10INO3
Molecular Weight
307.09
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

3-Iodo-L-Tyrosine

3-iodo-L-tyrosine is the monoiodotyrosine that is L-tyrosine carrying an iodo-substituent at position C-3 of the benzyl group. It has a role as an EC 1.14.16.2 (tyrosine 3-monooxygenase) inhibitor, a mouse metabolite and a human metabolite. It is a monoiodotyrosine, a L-tyrosine derivative and a non-proteinogenic L-alpha-amino acid. It is a tautomer of a 3-iodo-L-tyrosine zwitterion.

CAS Number70-78-0
PubChem CID439744
IUPAC Name(2S)-2-amino-3-(4-hydroxy-3-iodophenyl)propanoic acid
Molecular FormulaC9H10INO3
Molecular Weight307.08
XLogP-1.1
Topological Polar Surface Area83.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count14
Formal Charge0
Complexity212
SMILES
C1=CC(=C(C=C1C[C@@H](C(=O)O)N)I)O
InChI
InChI=1S/C9H10INO3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,11H2,(H,13,14)/t7-/m0/s1
InChIKey
UQTZMGFTRHFAAM-ZETCQYMHSA-N
Chemical Structure
2D Structure
2D structure of 3-Iodo-L-Tyrosine
CAS: 70-78-0
CID: 439744
Formula: C9H10INO3
MW: 307.08
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight307.08
XLogP3-1.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass306.97054
Monoisotopic Mass306.97054
Topological Polar Surface Area83.6 Ų
Heavy Atom Count14
Formal Charge0
Complexity212
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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