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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP006409

3-[(2R,3R)-4-[(4R,6R,7R)-4-ethoxy-6-(2-methoxy-2-oxoethyl)-5,5,7-trimethyl-6,7-dihydro-4H-1-benzofuran-2-yl]-2-(furan-3-yl)-3-methyl-6-oxo-2H-pyran-3-yl]propanoic acid

Formula: C29H36O9  |  Mol. Weight: 528.60 g/mol

IUPAC: 3-[(2R,3R)-4-[(4R,6R,7R)-4-ethoxy-6-(2-methoxy-2-oxoethyl)-5,5,7-trimethyl-6,7-dihydro-4H-1-benzofuran-2-yl]-2-(furan-3-yl)-3-methyl-6-oxo-2H-pyran-3-yl]propanoic acid

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Overview

Molecular Formula C29H36O9
Molecular Weight 528.60 g/mol
Canonical SMILES CCOC1C2=C(C(C(C1(C)C)CC(=O)OC)C)OC(=C2)C3=CC(=O)OC(C3(C)CCC(=O)O)C4=COC=C4

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy