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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP026071

(1R,2R,3R,5S,6R,9R,10R,12S,13R)-2,3,10-trihydroxy-6-[(2R)-4-(hydroxymethyl)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]-6,13-dimethyl-7-oxapentacyclo[10.8.0.02,9.05,9.013,18]icosa-15,18-diene-8,14-dione

Formula: C28H34O9  |  Mol. Weight: 514.60 g/mol

IUPAC: (1R,2R,3R,5S,6R,9R,10R,12S,13R)-2,3,10-trihydroxy-6-[(2R)-4-(hydroxymethyl)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]-6,13-dimethyl-7-oxapentacyclo[10.8.0.02,9.05,9.013,18]icosa-15,18-diene-8,14-dione

Overview

Molecular Formula C28H34O9
Molecular Weight 514.60 g/mol
Canonical SMILES CC1=C(CC(OC1=O)C2(C3CC(C4(C3(C(CC5C4CC=C6C5(C(=O)C=CC6)C)O)C(=O)O2)O)O)C)CO

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy