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L-Thyronine

CAT: 0804-HY-113082-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-113082-02Size:10 mg
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Description
L-Thyronine is a deiodinated thyroxine.
CAS Number
1596-67-4
UNSPSC
12352005
Hazard Statement
H315, H319, H335
Target
Endogenous Metabolite
Type
Reference compound
Related Pathways
Metabolic Enzyme/Protease
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/l-thyronine.html
Purity
98.91
Solubility
DMSO : 5 mg/mL (ultrasonic; warming; heat to 60°C)
Smiles
N[C@@H](CC1=CC=C(C=C1)OC2=CC=C(O)C=C2)C(O)=O
Molecular Formula
C15H15NO4
Molecular Weight
273.29
Precautions
H315, H319, H335
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
Human Endogenous Metabolite

Chemical Information

L-Thyronine

L-thyronine is a thyronine. It is a tautomer of a L-thyronine zwitterion.

CAS Number1596-67-4
PubChem CID5461103
IUPAC Name(2S)-2-amino-3-[4-(4-hydroxyphenoxy)phenyl]propanoic acid
Molecular FormulaC15H15NO4
Molecular Weight273.28
XLogP-0.7
Topological Polar Surface Area92.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count20
Formal Charge0
Complexity307
SMILES
C1=CC(=CC=C1C[C@@H](C(=O)O)N)OC2=CC=C(C=C2)O
InChI
InChI=1S/C15H15NO4/c16-14(15(18)19)9-10-1-5-12(6-2-10)20-13-7-3-11(17)4-8-13/h1-8,14,17H,9,16H2,(H,18,19)/t14-/m0/s1
InChIKey
KKCIOUWDFWQUBT-AWEZNQCLSA-N
Chemical Structure
2D Structure
2D structure of L-Thyronine
CAS: 1596-67-4
CID: 5461103
Formula: C15H15NO4
MW: 273.28
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight273.28
XLogP3-0.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass273.10010796
Monoisotopic Mass273.10010796
Topological Polar Surface Area92.8 Ų
Heavy Atom Count20
Formal Charge0
Complexity307
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