Drug General Information
Drug ID
D03PIO
Former ID
DNC010245
Drug Name
IODORESINIFERATOXIN
Drug Type
Small molecular drug
Indication Discovery agent Investigative [529209]
Structure
Download
2D MOL
Formula
C37H39IO9
Canonical SMILES
CC1CC2(C3C4C1(C5C=C(C(=O)C5(CC(=C4)COC(=O)CC6=CC(=C(C(=<br />C6)I)O)OC)O)C)OC(O3)(O2)CC7=CC=CC=C7)C(=C)C
InChI
1S/C37H39IO9/c1-20(2)35-16-22(4)37-26(33(35)45-36(46-35,47-37)18-23-9-7-6-8-10-23)12-25(17-34(42)29(37)11-21(3)32(34)41)19-44-30(39)15-24-13-27(38)31(40)28(14-24)43-5/h6-14,22,26,29,33,40,42H,1,15-19H2,2-5H3/t22-,26+,29-,33-,34-,35-,36-,37-/m1/s1
InChIKey
TZUJORCXGLGWDV-DZBJMWFRSA-N
PubChem Compound ID
Target and Pathway
Target(s) Transient receptor potential cation channel subfamily V member 4 Target Info Inhibitor [527001]
Vanilloid receptor 1 Target Info Inhibitor [529209]
Vanilloid receptor Target Info Inhibitor [529209]
KEGG Pathway Inflammatory mediator regulation of TRP channelshsa04080:Neuroactive ligand-receptor interaction
Inflammatory mediator regulation of TRP channels
NetPath Pathway IL2 Signaling Pathway
Pathway Interaction Database Trk receptor signaling mediated by the MAPK pathway
Trk receptor signaling mediated by PI3K and PLC-gamma
Reactome TRP channelsR-HSA-3295583:TRP channels
References
Ref 529209J Med Chem. 2008 Jan 10;51(1):57-67. Epub 2007 Dec 12.Stereospecific high-affinity TRPV1 antagonists: chiral N-(2-benzyl-3-pivaloyloxypropyl) 2-[4-(methylsulfonylamino)phenyl]propionamide analogues.
Ref 527001Bioorg Med Chem Lett. 2004 Apr 5;14(7):1693-6.N-4-methansulfonamidobenzyl-N'-2-substituted-4-tert-butyl-benzyl thioureas as potent vanilloid receptor antagonistic ligands.
Ref 529209J Med Chem. 2008 Jan 10;51(1):57-67. Epub 2007 Dec 12.Stereospecific high-affinity TRPV1 antagonists: chiral N-(2-benzyl-3-pivaloyloxypropyl) 2-[4-(methylsulfonylamino)phenyl]propionamide analogues.

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