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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP023438

23-O-Acetyl shengmanol xyloside

Formula: C37H58O10  |  Mol. Weight: 662.80 g/mol

IUPAC: [1-(3,3-dimethyloxiran-2-yl)-3-[13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-(3,4,5-trihydroxyoxan-2-yl)oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]butyl] acetate

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Overview

Molecular Formula C37H58O10
Molecular Weight 662.80 g/mol
Canonical SMILES CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)C)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy