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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP034592

(3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[[4-hydroxy-3-[2-hydroxy-5-[[(3R,4R)-4-[(4-hydroxy-3-methoxyphenyl)methyl]-5-oxooxolan-3-yl]methyl]-3-methoxyphenyl]-5-methoxyphenyl]methyl]oxolan-2-one

Formula: C41H44O12  |  Mol. Weight: 728.80 g/mol

IUPAC: (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[[4-hydroxy-3-[2-hydroxy-5-[[(3R,4R)-4-[(4-hydroxy-3-methoxyphenyl)methyl]-5-oxooxolan-3-yl]methyl]-3-methoxyphenyl]-5-methoxyphenyl]methyl]oxolan-2-one

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Overview

Molecular Formula C41H44O12
Molecular Weight 728.80 g/mol
Canonical SMILES COC1=C(C=C(C=C1)CC2COC(=O)C2CC3=CC(=C(C(=C3)OC)O)C4=C(C(=CC(=C4)CC5COC(=O)C5CC6=CC(=C(C=C6)O)OC)OC)O)OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy