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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP036708

Cleistanthoside A

Formula: C34H38O16  |  Mol. Weight: 702.70 g/mol

IUPAC: 9-(1,3-benzodioxol-5-yl)-4-[(2S,3R,4S,5R)-4,5-dimethoxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6,7-dimethoxy-3H-benzo[f][2]benzofuran-1-one

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Overview

Molecular Formula C34H38O16
Molecular Weight 702.70 g/mol
Canonical SMILES COC1COC(C(C1OC)OC2C(C(C(C(O2)CO)O)O)O)OC3=C4COC(=O)C4=C(C5=CC(=C(C=C53)OC)OC)C6=CC7=C(C=C6)OCO7

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy