Therapeutic Targets Database
BIDD Pharmainformatics Databases
 
   
   

 

TTD Drug ID: DNC009155

Drug Information
NameBRECANAVIR
SynonymsBRECANAVIR
IndicationNot AvailableExperimental    
Structure

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InChI1S/C33H41N3O10S2/c1-20(2)14-36(48(39,40)25-8-9-29-30(13-25)45-19-
44-29)15-28(37)27(35-33(38)46-31-17-43-32-26(31)10-11-41-32)12-22
-4-6-24(7-5-22)42-16-23-18-47-21(3)34-23/h4-9,13,18,20,26-28,31-3
2,37H,10-12,14-17,19H2,1-3H3,(H,35,38)/t26-,27-,28+,31-,32+/m0/s1
InChIKeyJORVRJNILJXMMG-OLNQLETPSA-N
Canonical SMILESCC1=NC(=CS1)COC2=CC=C(C=C2)CC(C(CN(CC(C)C)S(=O)(=O)C3=CC4=C(C=C3)OCO4)O)
NC(=O)OC5COC6C5CCO6    
Isomeric SMILESCC1=NC(=CS1)COC2=CC=C(C=C2)C[C@@H]([C@@H](CN(CC(C)C)S(=O)(=O)C3=CC4=C(C=
C3)OCO4)O)NC(=O)O[C@H]5CO[C@@H]6[C@H]5CCO6
CAS NumberCAS 313682-08-5
TargetP-glycoprotein 1Inhibitor[1]
Ref 1Antimicrob Agents Chemother. 2007 Oct;51(10):3498-504. Epub 2007 Jul 30.Effects of human immunodeficiency virus protease inhibitors on the intestinal absorption of tenofovir disoproxil fumarate in vitro. To Reference



 

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