BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP019054

(2S,3R,4S,5S,6R)-2-[[(1R,2S,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl)oxyoxan-3-yl]oxy-4-methyl-3,7,8-trioxabicyclo[4.2.0]octan-5-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Formula: C45H72O17  |  Mol. Weight: 885.00 g/mol

IUPAC: (2S,3R,4S,5S,6R)-2-[[(1R,2S,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl)oxyoxan-3-yl]oxy-4-methyl-3,7,8-trioxabicyclo[4.2.0]octan-5-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

3D View Find Similar

Overview

Molecular Formula C45H72O17
Molecular Weight 885.00 g/mol
Canonical SMILES CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)O)O)OC8C9C(C(C(O8)C)OC2C(C(C(C(O2)CO)O)O)O)OO9)C)C)C)OC1

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy