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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP037404

[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-hydroxy-5-[2-(3-hydroxy-4-methoxyphenyl)ethyl]phenoxy]oxan-2-yl]methyl 3-(3,4-dihydroxyphenyl)propanoate

Formula: C30H34O12  |  Mol. Weight: 586.60 g/mol

IUPAC: [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-hydroxy-5-[2-(3-hydroxy-4-methoxyphenyl)ethyl]phenoxy]oxan-2-yl]methyl 3-(3,4-dihydroxyphenyl)propanoate

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Overview

Molecular Formula C30H34O12
Molecular Weight 586.60 g/mol
Canonical SMILES COC1=C(C=C(C=C1)CCC2=CC(=CC(=C2)OC3C(C(C(C(O3)COC(=O)CCC4=CC(=C(C=C4)O)O)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy