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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP025584

2-methyl-1-[(1R,9R,12S,13S)-3,5,13-trihydroxy-12-(2-hydroxypropan-2-yl)-9-methyl-8-oxatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-6-yl]propan-1-one

Formula: C20H28O6  |  Mol. Weight: 364.40 g/mol

IUPAC: 2-methyl-1-[(1R,9R,12S,13S)-3,5,13-trihydroxy-12-(2-hydroxypropan-2-yl)-9-methyl-8-oxatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-6-yl]propan-1-one

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Overview

Molecular Formula C20H28O6
Molecular Weight 364.40 g/mol
Canonical SMILES CC(C)C(=O)C1=C(C=C(C2=C1OC3(CCC(C2C3O)C(C)(C)O)C)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy