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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP038643

4-[(1R)-1-(2,4-dihydroxyphenyl)-3-[2-hydroxy-4-methoxy-3-(3-methylbut-2-enyl)phenyl]propyl]-6-[(2R)-7-methoxy-8-(3-methylbut-2-enyl)-3,4-dihydro-2H-chromen-2-yl]benzene-1,3-diol

Formula: C42H48O8  |  Mol. Weight: 680.80 g/mol

IUPAC: 4-[(1R)-1-(2,4-dihydroxyphenyl)-3-[2-hydroxy-4-methoxy-3-(3-methylbut-2-enyl)phenyl]propyl]-6-[(2R)-7-methoxy-8-(3-methylbut-2-enyl)-3,4-dihydro-2H-chromen-2-yl]benzene-1,3-diol

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Overview

Molecular Formula C42H48O8
Molecular Weight 680.80 g/mol
Canonical SMILES CC(=CCC1=C(C=CC(=C1O)CCC(C2=C(C=C(C=C2)O)O)C3=C(C=C(C(=C3)C4CCC5=C(O4)C(=C(C=C5)OC)CC=C(C)C)O)O)OC)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy