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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP028244

methyl (4aR,9S,10aS)-5,6,9-trihydroxy-1,1-dimethyl-10-oxo-7-propan-2-yl-3,4,9,10a-tetrahydro-2H-phenanthrene-4a-carboxylate

Formula: C21H28O6  |  Mol. Weight: 376.40 g/mol

IUPAC: methyl (4aR,9S,10aS)-5,6,9-trihydroxy-1,1-dimethyl-10-oxo-7-propan-2-yl-3,4,9,10a-tetrahydro-2H-phenanthrene-4a-carboxylate

Overview

Molecular Formula C21H28O6
Molecular Weight 376.40 g/mol
Canonical SMILES CC(C)C1=C(C(=C2C(=C1)C(C(=O)C3C2(CCCC3(C)C)C(=O)OC)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy