Drug General Information
Drug ID
D03CDB
Former ID
DNC007913
Drug Name
PFFFFF
Drug Type
Small molecular drug
Indication Discovery agent Investigative [528518]
Structure
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2D MOL

3D MOL

Formula
C50H54N6O7
Canonical SMILES
C1CC(NC1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CC3=CC=CC=C3)C(=O<br />)NC(CC4=CC=CC=C4)C(=O)NC(CC5=CC=CC=C5)C(=O)NC(CC6=CC=CC<br />=C6)C(=O)O
InChI
1S/C50H54N6O7/c57-45(39-27-16-28-51-39)52-40(29-34-17-6-1-7-18-34)46(58)53-41(30-35-19-8-2-9-20-35)47(59)54-42(31-36-21-10-3-11-22-36)48(60)55-43(32-37-23-12-4-13-24-37)49(61)56-44(50(62)63)33-38-25-14-5-15-26-38/h1-15,17-26,39-44,51H,16,27-33H2,(H,52,57)(H,53,58)(H,54,59)(H,55,60)(H,56,61)(H,62,63)/t39-,40-,41-,42-,43-,44-/m0/s1
InChIKey
GFXHQPYZLJKWEI-WGXSSYHUSA-N
PubChem Compound ID
Target and Pathway
Target(s) Galectin-3 Target Info Inhibitor [528518]
NetPath Pathway TGF_beta_Receptor Signaling Pathway
Pathway Interaction Database Hedgehog signaling events mediated by Gli proteins
Regulation of Ras family activation
Reactome Advanced glycosylation endproduct receptor signaling
WikiPathways Spinal Cord Injury
AGE/RAGE pathway
Advanced glycosylation endproduct receptor signaling
References
Ref 528518Bioorg Med Chem Lett. 2007 Feb 1;17(3):793-8. Epub 2006 Oct 27.Discovery of galectin ligands in fully randomized combinatorial one-bead-one-compound (glyco)peptide libraries.
Ref 528518Bioorg Med Chem Lett. 2007 Feb 1;17(3):793-8. Epub 2006 Oct 27.Discovery of galectin ligands in fully randomized combinatorial one-bead-one-compound (glyco)peptide libraries.

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