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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP002518

[3-hydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 3-hydroxy-4-methoxybenzoate

Formula: C21H24O11  |  Mol. Weight: 452.40 g/mol

IUPAC: [3-hydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 3-hydroxy-4-methoxybenzoate

Overview

Molecular Formula C21H24O11
Molecular Weight 452.40 g/mol
Canonical SMILES COC1=C(C=C(C=C1)C(=O)OCC2=CC(=C(C=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy