L-(+)-Ergothioneine-d3

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For Research Use Only | Not For Clinical Use
CATAPS1356933895
CAS1356933-89-5
SynonymsL-(+)-Ergothioneine-d3, (2S)-2-[Dimethyl(trideuteriomethyl)azaniumyl]-3-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)propanoate, (S)-[1-Carboxy-2-(2-mercaptoimidazol-4-yl)ethyl]dimethyl(methyl-d3)ammonium, L-Ergothioneine-d3,1H-Imidazole-4-ethanaminium, α-carboxy-2,3-dihydro-N,N-dimethyl-N-(methyl-d3)-2-thioxo-, inner salt, (αS)-, L-Ergothioneine-D3 (N-methyl-D3), (αS)-α-Carboxy-2,3-dihydro-N,N-dimethyl-N-(methyl-d3)-2-thioxo-1H-imidazole-4-ethanaminium inner salt
IUPAC Name(2S)-2-[dimethyl(trideuteriomethyl)azaniumyl]-3-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)propanoate
Molecular Weight232.32
Molecular FormulaC92H3H12N3O2S
Canonical SMILES[2H]C([2H])([2H])[N+](C)(C)[C@@H](CC1=CNC(=S)N1)C(=O)[O-]
InChIInChI=1S/C9H15N3O2S/c1-12(2,3)7(8(13)14)4-6-5-10-9(15)11-6/h5,7H,4H2,1-3H3,(H2-,10,11,13,14,15)/t7-/m0/s1/i1D3
Accurate Mass232.1073
FormatNeat
Product TypeStable Isotope Labelled
ShippingRoom Temperature
Size1MG
Storage Conditions-20°C Freezer
SubcategoryFood additives, flavours and adulterants, Stable isotope labelled compounds
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