BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP007818

methyl (4S,5E,6S)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-octadec-9-enoyl]oxymethyl]oxan-2-yl]oxy-4H-pyran-3-carboxylate

Formula: C43H64O13  |  Mol. Weight: 789.00 g/mol

IUPAC: methyl (4S,5E,6S)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-octadec-9-enoyl]oxymethyl]oxan-2-yl]oxy-4H-pyran-3-carboxylate

3D View Find Similar

Overview

Molecular Formula C43H64O13
Molecular Weight 789.00 g/mol
Canonical SMILES CCCCCCCCC=CCCCCCCCC(=O)OCC1C(C(C(C(O1)OC2C(=CC)C(C(=CO2)C(=O)OC)CC(=O)OCCC3=CC=C(C=C3)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy