Drug Information

Drug General Information
Drug ID
D0D3OV
Former ID
DNC012827
Drug Name
AcAsp-Glu-Cha-Val-Prb-Cpg
Drug Type
Small molecular drug
Indication Discovery agent Investigative [527362]
Structure
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2D MOL

3D MOL
Formula
C41H58N6O13
Canonical SMILES
CC(C)C(C(=O)N1CC(CC1C(=O)NC2(CC2)C(=O)O)OCC3=CC=CC=C3)N<br />C(=O)C(CC4CCCCC4)NC(=O)C(CCC(=O)O)NC(=O)C(CC(=O)O)NC(=O<br />)C
InChI
1S/C41H58N6O13/c1-23(2)34(39(57)47-21-27(60-22-26-12-8-5-9-13-26)19-31(47)38(56)46-41(16-17-41)40(58)59)45-37(55)29(18-25-10-6-4-7-11-25)44-35(53)28(14-15-32(49)50)43-36(54)30(20-33(51)52)42-24(3)48/h5,8-9,12-13,23,25,27-31,34H,4,6-7,10-11,14-22H2,1-3H3,(H,42,48)(H,43,54)(H,44,53)(H,45,55)(H,46,56)(H,49,50)(H,51,52)(H,58,59)/t27-,28-,29-,30-,31-,34-/m0/s1
InChIKey
DDYNDQYNGBVAAZ-HWKKFYSMSA-N
PubChem Compound ID
44388180
Target and Pathway
Target(s) Nonstructural protein NS3 Target Info Inhibitor [527362]
References
Ref 527362J Med Chem. 2005 Jan 13;48(1):1-20.Control of hepatitis C: a medicinal chemistry perspective.
Ref 527362J Med Chem. 2005 Jan 13;48(1):1-20.Control of hepatitis C: a medicinal chemistry perspective.

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