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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP000949

[(2S,3R,4S,5S,6R)-2-[(2S,3R,4R,5S,6R)-5-acetyloxy-3-hydroxy-2-(2-hydroxy-3-methyl-6-propan-2-ylphenoxy)-6-methyloxan-4-yl]oxy-3,5-dihydroxy-6-methyloxan-4-yl] (Z)-2-methylbut-2-enoate

Formula: C29H42O12  |  Mol. Weight: 582.60 g/mol

IUPAC: [(2S,3R,4S,5S,6R)-2-[(2S,3R,4R,5S,6R)-5-acetyloxy-3-hydroxy-2-(2-hydroxy-3-methyl-6-propan-2-ylphenoxy)-6-methyloxan-4-yl]oxy-3,5-dihydroxy-6-methyloxan-4-yl] (Z)-2-methylbut-2-enoate

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Overview

Molecular Formula C29H42O12
Molecular Weight 582.60 g/mol
Canonical SMILES CC=C(C)C(=O)OC1C(C(OC(C1O)OC2C(C(OC(C2OC(=O)C)C)OC3=C(C=CC(=C3O)C)C(C)C)O)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy