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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP004038

[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[(3R,6R)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenoxy]oxan-2-yl]methyl acetate

Formula: C30H38O14  |  Mol. Weight: 622.60 g/mol

IUPAC: [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[(3R,6R)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenoxy]oxan-2-yl]methyl acetate

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Overview

Molecular Formula C30H38O14
Molecular Weight 622.60 g/mol
Canonical SMILES CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C(C=C2OC)C3C4COC(C4CO3)C5=CC(=C(C(=C5)OC)O)OC)OC)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy