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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP000420

cassumunin B

Formula: C34H36O9  |  Mol. Weight: 588.60 g/mol

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

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Overview

Molecular Formula C34H36O9
Molecular Weight 588.60 g/mol
Canonical SMILES CC(C=CC1=CC(=C(C=C1OC)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