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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP005529

[(1R,2S,4R,5S,6R,8R,10R,11R)-2-acetyloxy-5-[2-[(3S)-2-hydroxyoxolan-3-yl]ethyl]-4,5-dimethylspiro[9-oxatricyclo[6.2.2.01,6]dodecane-11,2'-oxirane]-10-yl] (E)-2-methylbut-2-enoate

Formula: C27H40O8  |  Mol. Weight: 492.60 g/mol

IUPAC: [(1R,2S,4R,5S,6R,8R,10R,11R)-2-acetyloxy-5-[2-[(3S)-2-hydroxyoxolan-3-yl]ethyl]-4,5-dimethylspiro[9-oxatricyclo[6.2.2.01,6]dodecane-11,2'-oxirane]-10-yl] (E)-2-methylbut-2-enoate

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Overview

Molecular Formula C27H40O8
Molecular Weight 492.60 g/mol
Canonical SMILES CC=C(C)C(=O)OC1C23C(CC(O1)CC24CO4)C(C(CC3OC(=O)C)C)(C)CCC5CCOC5O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy