Chemical Compound

Thioneine

CAS Registry Number 497-30-3
Thioneine chemical structure
Primary Record

Thioneine

In stock
996 g
Purity
98.6 %
CAS
497-30-3

Compound Identifiers & Properties

CAS
497-30-3
PubChem CID
5351468
SMILES
C[N+](C)(C)[C@H](CC1=CNC(=S)N1)C(=O)[O-]
Canonical SMILES
C[N+](C)(C)[C@H](Cc1c[nH]c(=S)[nH]1)C(=O)[O-]

Names & Synonyms

  • Thioneine
  • Sympectothion
  • Thiasine
  • Thiotane
  • D-Ergothioneine
  • (R)-Ergothioneine
  • 2-Mercapto-histidine
  • L-(+)-Ergothioneine
  • 2-Mercaptohistidine Betaine
  • AC1NS0M6
  • SCHEMBL9986385
  • GLXC-26431
  • NSC 7175
  • CID5351468
  • 2-Mercapto-N,N-dimethylhistidine Methyl Ester Betaine
  • (2R)-3-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)-2-(trimethylazaniumyl)propanoate
  • (R)-3-(2-Thioxo-2,3-dihydro-1H-imidazol-4-yl)-2-(trimethylammonio)propanoate
  • (|AS)-|A-Carboxy-2,3-dihydro-N,N,N-trimethyl-2-thioxo-1H-imidazole-4-ethanaminium Inner Salt
  • 497-30-3