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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP024092

Glycinoeclepin B

Formula: C31H42O9  |  Mol. Weight: 558.70 g/mol

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

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Overview

Molecular Formula C31H42O9
Molecular Weight 558.70 g/mol
Canonical SMILES CC(CC(C=C(C)C(=O)O)O)C1(CC=C2C1(C(CC(=C2C(=O)O)CC34CCC(O3)C(C4=O)(C)C)OC(=O)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy