BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP036038

Brevilagin I

Formula: C34H24O24  |  Mol. Weight: 816.50 g/mol

IUPAC: (1S,3R,4R,21R,22S)-10,10,14,15,16,28,28,32,33,34-decahydroxy-3-(hydroxymethyl)-2,5,20,23,38-pentaoxaheptacyclo[19.17.0.04,22.07,12.013,18.025,30.031,36]octatriaconta-7,13,15,17,25,31,33,35-octaene-6,9,11,19,24,27,29,37-octone

3D View Find Similar

Overview

Molecular Formula C34H24O24
Molecular Weight 816.50 g/mol
Canonical SMILES C1=C2C(C3=C(C(=C(C=C3C(=O)OC4C5C(C(OC4OC(=O)C6=CC(=C(C(=C6C7C(=CC(=O)C(C7=O)(O)O)C(=O)O5)O)O)O)CO)OC2=O)O)O)O)C(=O)C(C1=O)(O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy