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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP020101

methyl 2-[(1S,5R,6R,12R,14S,15R,17S,18S)-14-acetyloxy-6-(furan-3-yl)-17-hydroxy-1,5,15-trimethyl-8,13-dioxo-7-oxapentacyclo[13.2.1.02,11.05,10.012,17]octadeca-2(11),9-dien-18-yl]acetate

Formula: C29H32O9  |  Mol. Weight: 524.60 g/mol

IUPAC: methyl 2-[(1S,5R,6R,12R,14S,15R,17S,18S)-14-acetyloxy-6-(furan-3-yl)-17-hydroxy-1,5,15-trimethyl-8,13-dioxo-7-oxapentacyclo[13.2.1.02,11.05,10.012,17]octadeca-2(11),9-dien-18-yl]acetate

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Overview

Molecular Formula C29H32O9
Molecular Weight 524.60 g/mol
Canonical SMILES CC(=O)OC1C(=O)C2C3=C(CCC4(C3=CC(=O)OC4C5=COC=C5)C)C6(C2(CC1(C6CC(=O)OC)C)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy