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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP037295

(2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5R,6R)-3,5-dihydroxy-2-[(2E,4R)-4-hydroxy-3,7-dimethylocta-2,6-dienoxy]-6-(hydroxymethyl)oxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

Formula: C22H38O12  |  Mol. Weight: 494.50 g/mol

IUPAC: (2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5R,6R)-3,5-dihydroxy-2-[(2E,4R)-4-hydroxy-3,7-dimethylocta-2,6-dienoxy]-6-(hydroxymethyl)oxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

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Overview

Molecular Formula C22H38O12
Molecular Weight 494.50 g/mol
Canonical SMILES CC(=CCC(C(=CCOC1C(C(C(C(O1)CO)O)OC2C(C(C(C(O2)CO)O)O)O)O)C)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy