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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP011139

Valerosidate

Formula: C21H34O11  |  Mol. Weight: 462.50 g/mol

IUPAC: [(1S,4aS,6S,7S,7aS)-6,7-dihydroxy-7-methyl-4-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-1-yl] 3-methylbutanoate

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Overview

Molecular Formula C21H34O11
Molecular Weight 462.50 g/mol
Canonical SMILES CC(C)CC(=O)OC1C2C(CC(C2(C)O)O)C(=CO1)COC3C(C(C(C(O3)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy