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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP009777

[(1S,3bR,4R,5aR,10aR,10bR,12aS)-1-[(3S,5R)-5-hydroxy-6-oxooxan-3-yl]-3b,6,6,10a,12a-pentamethyl-8-oxo-1,2,4,5,5a,10b,11,12-octahydroindeno[5,4-g][2]benzoxepin-4-yl] acetate

Formula: C29H40O7  |  Mol. Weight: 500.60 g/mol

IUPAC: [(1S,3bR,4R,5aR,10aR,10bR,12aS)-1-[(3S,5R)-5-hydroxy-6-oxooxan-3-yl]-3b,6,6,10a,12a-pentamethyl-8-oxo-1,2,4,5,5a,10b,11,12-octahydroindeno[5,4-g][2]benzoxepin-4-yl] acetate

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Overview

Molecular Formula C29H40O7
Molecular Weight 500.60 g/mol
Canonical SMILES CC(=O)OC1CC2C(OC(=O)C=CC2(C3C1(C4=CCC(C4(CC3)C)C5CC(C(=O)OC5)O)C)C)(C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy