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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP007921

[(1R,2S,4R,6R,9R,10R,11R,12S,14R,15R,18R)-6-(furan-3-yl)-10-(2-methoxy-2-oxoethyl)-7,9,11,15-tetramethyl-12-[(E)-3-phenylprop-2-enoyl]oxy-3,17-dioxapentacyclo[9.6.1.02,9.04,8.015,18]octadec-7-en-14-yl] (E)-2-methylbut-2-enoate

Formula: C41H48O9  |  Mol. Weight: 684.80 g/mol

IUPAC: [(1R,2S,4R,6R,9R,10R,11R,12S,14R,15R,18R)-6-(furan-3-yl)-10-(2-methoxy-2-oxoethyl)-7,9,11,15-tetramethyl-12-[(E)-3-phenylprop-2-enoyl]oxy-3,17-dioxapentacyclo[9.6.1.02,9.04,8.015,18]octadec-7-en-14-yl] (E)-2-methylbut-2-enoate

Overview

Molecular Formula C41H48O9
Molecular Weight 684.80 g/mol
Canonical SMILES CC=C(C)C(=O)OC1CC(C2(C(C3(C(C4C2C1(CO4)C)OC5C3=C(C(C5)C6=COC=C6)C)C)CC(=O)OC)C)OC(=O)C=CC7=CC=CC=C7

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy