Chemical Compound

ERGOTHIONEINE

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

ERGOTHIONEINE

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

Compound Identifiers & Properties

CAS
497-30-3
PubChem CID
57509571
SMILES
C[N+](C)(C)[C@@H](CC1=CN=C(N1)[S-])C(=O)O
Canonical SMILES
C[N+](C)(C)[C@@H](Cc1cnc([S-])[nH]1)C(=O)O

Names & Synonyms

  • ERGOTHIONEINE
  • L(+)-Ergothioneine
  • C9H15N3O2S
  • SSISHJJTAXXQAX-ZETCQYMHSA-N
  • MFCD00167474
  • 497-30-3
  • (2S)-3-(2-thioxo-1,3-dihydroimidazol-4-yl)-2-(trimethylammonio)propanoate
  • (S)-3-(2-Thioxo-2,3-dihydro-1H-imidazol-4-yl)-2-(trimethylammonio)propanoate