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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP012700

[(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl] (4R)-4-acetyloxy-2,6,6-trimethylcyclohexene-1-carboxylate

Formula: C26H36O13  |  Mol. Weight: 556.60 g/mol

IUPAC: [(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl] (4R)-4-acetyloxy-2,6,6-trimethylcyclohexene-1-carboxylate

Overview

Molecular Formula C26H36O13
Molecular Weight 556.60 g/mol
Canonical SMILES CC1=C(C(CC(C1)OC(=O)C)(C)C)C(=O)OC2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy