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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP034953

4-(Methylsulfinyl)but-3-enylglucosinolate

Formula: C12H21NO10S3  |  Mol. Weight: 435.50 g/mol

IUPAC: [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (E,1E)-5-methylsulfinyl-N-sulfooxypent-4-enimidothioate

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Overview

Molecular Formula C12H21NO10S3
Molecular Weight 435.50 g/mol
Canonical SMILES CS(=O)C=CCCC(=NOS(=O)(=O)O)SC1C(C(C(C(O1)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy