Deuterium-substituted L-DOPA   Click here for help

GtoPdb Ligand ID: 8611

Abbreviated name: D3 L-DOPA
Synonyms: DP-102
Compound class: Synthetic organic
Comment: Chronic treatment with a substantially lower dose of deuterium-substituted L-DOPA (D3-L-DOPA), compared with L-DOPA (levodopa) produced equal anti-parkinsonian effects and reduced dyskinesia in 6-OHDA-lesioned rats [2]. This new rat study reports similar effect produced by D3-L-DOPA and selegiline plus L-DOPA, respectively, implying adjuvant MAO-B inhibitor treatment may not be necessary with D3-L-DOPA [1]. This compound was proposed for development by the Michael J Fox foundation but there is no entry.
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 4
Rotatable bonds 3
Topological polar surface area 103.78
Molecular weight 197.07
XLogP -2.03
No. Lipinski's rules broken 0
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Canonical SMILES OC(=O)C(Cc1ccc(c(c1)O)O)N
Isomeric SMILES OC(=O)[C@](C(c1ccc(c(c1)O)O)([2H])[2H])(N)[2H]
InChI InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14)/t6-/m0/s1/i3D2,6D
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
(2S)-2-amino-2,3,3-trideuterio-3-(3,4-dihydroxyphenyl)propanoic acid
Synonyms Click here for help
Database Links Click here for help
GtoPdb PubChem SID 252166812
PubChem CID 76955701
Search Google for chemical match using the InChIKey WTDRDQBEARUVNC-QZRTVAIESA-N
Search Google for chemicals with the same backbone WTDRDQBEARUVNC
UniChem Compound Search for chemical match using the InChIKey WTDRDQBEARUVNC-QZRTVAIESA-N
UniChem Connectivity Search for chemical match using the InChIKey WTDRDQBEARUVNC-QZRTVAIESA-N