Therapeutic Targets Database
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TTD Drug ID: DNC000836

Drug Information
NameKNI-727
IndicationNot AvailableExperimental    
Structure

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InChI1S/C30H41N3O5S/c1-19-12-11-13-20(2)25(19)38-17-23(34)31-22(16-21-
14-9-8-10-15-21)24(35)28(37)33-18-39-30(6,7)26(33)27(36)32-29(3,4
)5/h8-15,22,24,26,35H,16-18H2,1-7H3,(H,31,34)(H,32,36)/t22-,24-,2
6+/m0/s1
InChIKeyCSWRAOHDICNMPU-LLZJGCNPSA-N
Canonical SMILESCC1=C(C(=CC=C1)C)OCC(=O)NC(CC2=CC=CC=C2)C(C(=O)N3CSC(C3C(=O)NC(C)(C)C)
(C)C)O    
Isomeric SMILESCC1=C(C(=CC=C1)C)OCC(=O)N[C@@H](CC2=CC=CC=C2)[C@@H](C(=O)N3CSC([C@H]3C(=
O)NC(C)(C)C)(C)C)O
CAS NumberCAS 189357-33-3
PubChem Compound IDCID 451416.
PubChem Substance IDSID 596010.
TargetPlasmepsin 2Inhibitor[1]
Ref 1Identification and characterization of allophenylnorstatine-based inhibitors of plasmepsin II, an antimalarial target. Biochemistry. 2002 Feb 19;41(7):2273-80. To Reference



 

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