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Chemical structure of L-DOPA-d6

GC71832

L-DOPA-d6

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

L-DOPA-d6 is the deuterium labeled L-DOPA

ChemicalCAS713140-75-1MW203.22FormulaC9H5D6NO4
CAS number
713140-75-1
Molecular weight
203.22
Formula
C9H5D6NO4
Solubility
0·1 M HCL ： 20 mg/mL (98·42 mM; ultrasonic and warming and adjust pH to 2 with HCl and heat to 60°C); H2O ： 1 mg/mL (4·92 mM; Need ultrasonic)
InChIKey
WTDRDQBEARUVNC-ZAZUUIAJSA-N
Catalogue number
GC71832
Brand
GLPBIO
Computed properties PubChem CID 141611948 · XLogP -2.7 · TPSA 104 Ų · H-bond donors 4
XLogP
-2.7
TPSA
104 Ų
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
14

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

Computed descriptors from PubChem (CID 141611948), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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