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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP011166

cassumunin A

Formula: C33H34O8  |  Mol. Weight: 558.60 g/mol

IUPAC: (1E,6E)-1-[3-[(E)-4-(3,4-dimethoxyphenyl)but-3-en-2-yl]-4-hydroxy-5-methoxyphenyl]-7-(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione

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Overview

Molecular Formula C33H34O8
Molecular Weight 558.60 g/mol
Canonical SMILES CC(C=CC1=CC(=C(C=C1)OC)OC)C2=C(C(=CC(=C2)C=CC(=O)CC(=O)C=CC3=CC(=C(C=C3)O)OC)OC)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy