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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP035821

5-Oxoheptyl glucosinolate

Formula: C14H27NO10S2  |  Mol. Weight: 433.50 g/mol

IUPAC: [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1Z)-6-oxo-N-(trihydroxy-lambda4-sulfanyl)oxyoctanimidothioate

Overview

Molecular Formula C14H27NO10S2
Molecular Weight 433.50 g/mol
Canonical SMILES CCC(=O)CCCCC(=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