BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP002084

[(1S,2S,3R,4S,5S,7S,9R,10R,12R,15S,16R,17S)-4,9,15-triacetyloxy-3-benzoyloxy-5,10-dihydroxy-2,6,6,12-tetramethyl-11,13-dioxatetracyclo[8.7.0.02,7.012,16]heptadecan-17-yl] benzoate

Formula: C39H46O14  |  Mol. Weight: 738.80 g/mol

IUPAC: [(1S,2S,3R,4S,5S,7S,9R,10R,12R,15S,16R,17S)-4,9,15-triacetyloxy-3-benzoyloxy-5,10-dihydroxy-2,6,6,12-tetramethyl-11,13-dioxatetracyclo[8.7.0.02,7.012,16]heptadecan-17-yl] benzoate

3D View Find Similar

Overview

Molecular Formula C39H46O14
Molecular Weight 738.80 g/mol
Canonical SMILES CC(=O)OC1CC2C(C(C(C(C2(C3C1(OC4(C(C3OC(=O)C5=CC=CC=C5)C(CO4)OC(=O)C)C)O)C)OC(=O)C6=CC=CC=C6)OC(=O)C)O)(C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy