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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP004295

[(2S,3R,4S,5S,6R)-2-[[(1S,4aR,5S,7aS)-5-hydroxy-7-(hydroxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] benzoate

Formula: C22H26O10  |  Mol. Weight: 450.40 g/mol

IUPAC: [(2S,3R,4S,5S,6R)-2-[[(1S,4aR,5S,7aS)-5-hydroxy-7-(hydroxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] benzoate

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Overview

Molecular Formula C22H26O10
Molecular Weight 450.40 g/mol
Canonical SMILES C1=CC=C(C=C1)C(=O)OC2C(C(C(OC2OC3C4C(C=CO3)C(C=C4CO)O)CO)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy