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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP012367

[(1S,2R,4aS,5S,8aS)-1-[2-(furan-3-yl)ethyl]-1-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-3-oxo-4a,6,7,8-tetrahydro-4H-naphthalen-2-yl] acetate

Formula: C22H32O6  |  Mol. Weight: 392.50 g/mol

IUPAC: [(1S,2R,4aS,5S,8aS)-1-[2-(furan-3-yl)ethyl]-1-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-3-oxo-4a,6,7,8-tetrahydro-4H-naphthalen-2-yl] acetate

Overview

Molecular Formula C22H32O6
Molecular Weight 392.50 g/mol
Canonical SMILES CC(=O)OC1(C(=O)CC2C(CCCC2(C1(CCC3=COC=C3)O)C)(C)CO)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy