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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP006917

[(1S,2S,4S,5S,6R,10S)-5-hydroxy-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-2-yl]methyl (Z)-3-(4-methoxyphenyl)prop-2-enoate

Formula: C25H30O12  |  Mol. Weight: 522.50 g/mol

IUPAC: [(1S,2S,4S,5S,6R,10S)-5-hydroxy-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-2-yl]methyl (Z)-3-(4-methoxyphenyl)prop-2-enoate

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Overview

Molecular Formula C25H30O12
Molecular Weight 522.50 g/mol
Canonical SMILES COC1=CC=C(C=C1)C=CC(=O)OCC23C4C(C=COC4OC5C(C(C(C(O5)CO)O)O)O)C(C2O3)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy