BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP037850

[(10R,11S,12R,13S,15R)-3,4,5,24,25,26,32-heptahydroxy-8,18,29-trioxo-12,13-bis[(3,4,5-trihydroxybenzoyl)oxy]-9,14,17,22,30-pentaoxahexacyclo[17.13.0.02,7.010,15.021,31.023,28]dotriaconta-1(32),2,4,6,19,21(31),23,25,27-nonaen-11-yl] 3,4,5-trihydroxybenzoate

Formula: C48H32O30  |  Mol. Weight: 1088.70 g/mol

IUPAC: [(10R,11S,12R,13S,15R)-3,4,5,24,25,26,32-heptahydroxy-8,18,29-trioxo-12,13-bis[(3,4,5-trihydroxybenzoyl)oxy]-9,14,17,22,30-pentaoxahexacyclo[17.13.0.02,7.010,15.021,31.023,28]dotriaconta-1(32),2,4,6,19,21(31),23,25,27-nonaen-11-yl] 3,4,5-trihydroxybenzoate

Overview

Molecular Formula C48H32O30
Molecular Weight 1088.70 g/mol
Canonical SMILES C1C2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)OC(=O)C6=CC(=C(C(=C6C7=C(C8=C(C=C7C(=O)O1)OC9=C(C(=C(C=C9C(=O)O8)O)O)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy