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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP036080

2'-(4-Hydroxyphenylacetyl)-6'-(4-hydroxy-3-methylbutanoyl)-phloroacetophenone 4'-[rhamnosyl-(1->2)-glucoside]

Formula: C33H42O17  |  Mol. Weight: 710.70 g/mol

IUPAC: [2-acetyl-5-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-3-[2-(4-hydroxyphenyl)acetyl]oxyphenyl] 4-hydroxy-3-methylbutanoate

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Overview

Molecular Formula C33H42O17
Molecular Weight 710.70 g/mol
Canonical SMILES CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C(C(=C3)OC(=O)CC(C)CO)C(=O)C)OC(=O)CC4=CC=C(C=C4)O)CO)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy