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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP007580

methyl (2S)-2-[(1S,2R,5S,6S,10S,12S,13R,15S,16R,18S,19S)-18-acetyloxy-6-(furan-3-yl)-15-hydroxy-1,5,16-trimethyl-8,14-dioxo-7,11-dioxahexacyclo[14.2.1.02,12.05,10.010,12.013,18]nonadecan-19-yl]-2-hydroxyacetate

Formula: C29H34O11  |  Mol. Weight: 558.60 g/mol

IUPAC: methyl (2S)-2-[(1S,2R,5S,6S,10S,12S,13R,15S,16R,18S,19S)-18-acetyloxy-6-(furan-3-yl)-15-hydroxy-1,5,16-trimethyl-8,14-dioxo-7,11-dioxahexacyclo[14.2.1.02,12.05,10.010,12.013,18]nonadecan-19-yl]-2-hydroxyacetate

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Overview

Molecular Formula C29H34O11
Molecular Weight 558.60 g/mol
Canonical SMILES CC(=O)OC12CC3(C(C(=O)C1C45C(C2(C3C(C(=O)OC)O)C)CCC6(C4(O5)CC(=O)OC6C7=COC=C7)C)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy