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Chemical structure of 3-Nitro-L-tyrosine-d3

GC74886

3-Nitro-L-tyrosine-d3

Also known as (2S)-2-amino-3-(2,3,6-trideuterio-4-hydroxy-5-nitrophenyl)propanoic acid

3-Nitro-L-tyrosine-d3 is the deuterium labeled 3-Nitro-L-tyrosine

ChemicalCAS213386-10-8MW229.2FormulaC9H7D3N2O5
CAS number
213386-10-8
Molecular weight
229.2
Formula
C9H7D3N2O5
Solubility
H2O: 5 mg/mL (21·82 mM; ultrasonic and warming and adjust pH to 2 with HCl and heat to 60°C)
InChIKey
FBTSQILOGYXGMD-UOCCHMHCSA-N
Catalogue number
GC74886
Brand
GLPBIO
Computed properties PubChem CID 10846994 · XLogP -2 · TPSA 129 Ų · H-bond donors 3
XLogP
-2
TPSA
129 Ų
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
16

SMILES [2H]C1=C(C(=C(C(=C1C[C@@H](C(=O)O)N)[2H])[N+](=O)[O-])O)[2H]

Computed descriptors from PubChem (CID 10846994), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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