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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP039199

[4-[5-methoxy-7-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]oxy-4-oxochromen-2-yl]phenyl]methyl (3S)-3-ethylheptanoate

Formula: C36H38O8  |  Mol. Weight: 598.70 g/mol

IUPAC: [4-[5-methoxy-7-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]oxy-4-oxochromen-2-yl]phenyl]methyl (3S)-3-ethylheptanoate

Overview

Molecular Formula C36H38O8
Molecular Weight 598.70 g/mol
Canonical SMILES CCCCC(CC)CC(=O)OCC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C=C3OC)OC(=O)C=CC4=CC=C(C=C4)OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy