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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP037287

[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(1S,2S,4S,5S,6R,8S,10S)-5-hydroxy-2-(hydroxymethyl)-8-methoxy-3,9-dioxatricyclo[4.4.0.02,4]decan-10-yl]oxy]oxan-2-yl]methyl (E)-3-phenylprop-2-enoate

Formula: C25H32O12  |  Mol. Weight: 524.50 g/mol

IUPAC: [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(1S,2S,4S,5S,6R,8S,10S)-5-hydroxy-2-(hydroxymethyl)-8-methoxy-3,9-dioxatricyclo[4.4.0.02,4]decan-10-yl]oxy]oxan-2-yl]methyl (E)-3-phenylprop-2-enoate

Overview

Molecular Formula C25H32O12
Molecular Weight 524.50 g/mol
Canonical SMILES COC1CC2C(C(O1)OC3C(C(C(C(O3)COC(=O)C=CC4=CC=CC=C4)O)O)O)C5(C(C2O)O5)CO

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy