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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP013762

4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3,5,7(20),15,18-hexaen-12-one

Formula: C25H30O8  |  Mol. Weight: 458.50 g/mol

IUPAC: 4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3,5,7(20),15,18-hexaen-12-one

Overview

Molecular Formula C25H30O8
Molecular Weight 458.50 g/mol
Canonical SMILES C1CCC2=CC(=C(C=C2)OC3C(C(C(C(O3)CO)O)O)O)OC4=CC=C(CCC(=O)C1)C=C4

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy