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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP004549

(3R,3aS,6aS)-3-[3,5-dimethoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3,3a,4,6a-tetrahydro-1H-furo[3,4-c]furan-6-one

Formula: C20H26O11  |  Mol. Weight: 442.40 g/mol

IUPAC: (3R,3aS,6aS)-3-[3,5-dimethoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3,3a,4,6a-tetrahydro-1H-furo[3,4-c]furan-6-one

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Overview

Molecular Formula C20H26O11
Molecular Weight 442.40 g/mol
Canonical SMILES COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C3C4COC(=O)C4CO3

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy