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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP014704

[(4aR,4bR,7R,8aR,9R,10aR)-7-ethenyl-8a,9-dihydroxy-1,1,4a,7-tetramethyl-2,5,8-trioxo-6,9,10,10a-tetrahydro-4bH-phenanthren-3-yl] acetate

Formula: C22H28O7  |  Mol. Weight: 404.50 g/mol

IUPAC: [(4aR,4bR,7R,8aR,9R,10aR)-7-ethenyl-8a,9-dihydroxy-1,1,4a,7-tetramethyl-2,5,8-trioxo-6,9,10,10a-tetrahydro-4bH-phenanthren-3-yl] acetate

Overview

Molecular Formula C22H28O7
Molecular Weight 404.50 g/mol
Canonical SMILES CC(=O)OC1=CC2(C(CC(C3(C2C(=O)CC(C3=O)(C)C=C)O)O)C(C1=O)(C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy