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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP086668

Ergothioneine

Formula: C9H15N3O2S  |  Mol. Weight: 229.30 g/mol

IUPAC: (2S)-3-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)-2-(trimethylazaniumyl)propanoate

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Overview

Molecular Formula C9H15N3O2S
Molecular Weight 229.30 g/mol
Canonical SMILES C[N+](C)(C)C(CC1=CNC(=S)N1)C(=O)[O-]

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy

Therapeutics & Targets

Disease Associations