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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP001758

[(2S,3R,4R)-4-[(4-acetyloxy-3-methoxyphenyl)methyl]-2-[3-methoxy-4-[(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyphenyl]oxolan-3-yl]methyl acetate

Formula: C38H46O17  |  Mol. Weight: 774.80 g/mol

IUPAC: [(2S,3R,4R)-4-[(4-acetyloxy-3-methoxyphenyl)methyl]-2-[3-methoxy-4-[(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyphenyl]oxolan-3-yl]methyl acetate

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Overview

Molecular Formula C38H46O17
Molecular Weight 774.80 g/mol
Canonical SMILES CC(=O)OCC1C(COC1C2=CC(=C(C=C2)OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC)CC4=CC(=C(C=C4)OC(=O)C)OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy