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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP008636

[(E)-[(3R)-3-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-sulfanyloxan-2-yl]hex-5-enylidene]amino] hydrogen sulfate

Formula: C12H21NO10S2  |  Mol. Weight: 403.40 g/mol

IUPAC: [(E)-[(3R)-3-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-sulfanyloxan-2-yl]hex-5-enylidene]amino] hydrogen sulfate

Overview

Molecular Formula C12H21NO10S2
Molecular Weight 403.40 g/mol
Canonical SMILES C=CCC(CC(=NOS(=O)(=O)O)C1(C(C(C(C(O1)CO)O)O)O)S)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy