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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP008749

(6R)-6-[(1S,3R,6S,8R,10S,11S,12S,14S,15R,16R)-6,14-dihydroxy-7,7,12,16-tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-2-hydroxy-2-methylheptan-3-one

Formula: C36H60O10  |  Mol. Weight: 652.90 g/mol

IUPAC: (6R)-6-[(1S,3R,6S,8R,10S,11S,12S,14S,15R,16R)-6,14-dihydroxy-7,7,12,16-tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-2-hydroxy-2-methylheptan-3-one

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Overview

Molecular Formula C36H60O10
Molecular Weight 652.90 g/mol
Canonical SMILES CC(CCC(=O)C(C)(C)O)C1C(CC2(C1(CCC34C2C(CC5C3(C4)CCC(C5(C)C)O)OC6C(C(C(C(O6)CO)O)O)O)C)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy