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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP028464

(1S,7R,7aS)-1-[(2R)-1-carboxypropan-2-yl]-5-[[(1S,4S)-3,3-dimethyl-2-oxo-7-oxabicyclo[2.2.1]heptan-1-yl]methyl]-7-hydroxy-1,7a-dimethyl-6,7-dihydro-2H-indene-4-carboxylic acid

Formula: C25H34O7  |  Mol. Weight: 446.50 g/mol

IUPAC: (1S,7R,7aS)-1-[(2R)-1-carboxypropan-2-yl]-5-[[(1S,4S)-3,3-dimethyl-2-oxo-7-oxabicyclo[2.2.1]heptan-1-yl]methyl]-7-hydroxy-1,7a-dimethyl-6,7-dihydro-2H-indene-4-carboxylic acid

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Overview

Molecular Formula C25H34O7
Molecular Weight 446.50 g/mol
Canonical SMILES CC(CC(=O)O)C1(CC=C2C1(C(CC(=C2C(=O)O)CC34CCC(O3)C(C4=O)(C)C)O)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy