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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP001869

3-[4-[(1S,2S)-1-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxypropan-2-yl]oxy-3,5-dimethoxyphenyl]propyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

Formula: C41H44O14  |  Mol. Weight: 760.80 g/mol

IUPAC: 3-[4-[(1S,2S)-1-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxypropan-2-yl]oxy-3,5-dimethoxyphenyl]propyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

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Overview

Molecular Formula C41H44O14
Molecular Weight 760.80 g/mol
Canonical SMILES COC1=CC(=CC(=C1OC(COC(=O)C=CC2=CC(=C(C=C2)O)OC)C(C3=CC(=C(C=C3)O)OC)O)OC)CCCOC(=O)C=CC4=CC(=C(C=C4)O)OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy