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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP038983

[(2R)-1-[(1S,2S)-2-[(S)-acetyloxy-[(2R)-6-oxo-2,3-dihydropyran-2-yl]methyl]cyclopropyl]-1-oxopropan-2-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

Formula: C23H24O9  |  Mol. Weight: 444.40 g/mol

IUPAC: [(2R)-1-[(1S,2S)-2-[(S)-acetyloxy-[(2R)-6-oxo-2,3-dihydropyran-2-yl]methyl]cyclopropyl]-1-oxopropan-2-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

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Overview

Molecular Formula C23H24O9
Molecular Weight 444.40 g/mol
Canonical SMILES CC(C(=O)C1CC1C(C2CC=CC(=O)O2)OC(=O)C)OC(=O)C=CC3=CC(=C(C=C3)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy