KSL-128114 (trifluoroacetate salt)

A peptide syntenin inhibitor

Catalog Number 36984
Alternative Name(s) Ac-rRrGrKkRrSHWX1X2DI-OH (X1=tert-Leucine; X2=Cyclohexylglycine)
Research Area Cancer|Cell Death
Molecular Formula C96H165N39O21 • XCF3COOH
Purity 95%
Inchi InChI=1S/C96H165N39O21.C2HF3O2/c1-7-51(2)72(89(155)156)133-84(150)68(45-71(139)140)131-87(153)73(53-23-9-8-10-24-53)134-88(154)74(96(4,5)6)135-85(151)66(43-54-46-118-57-26-12-11-25-56(54)57)129-83(149)67(44-55-47-111-50-120-55)130-86(152)69(49-136)132-82(148)65(34-22-42-117-95(109)110)128-81(147)64(33-21-41-116-94(107)108)127-79(145)62(28-14-16-36-98)125-78(144)61(27-13-15-35-97)124-77(143)60(31-19-39-114-92(103)104)122-70(138)48-119-75(141)58(29-17-37-112-90(99)100)123-80(146)63(32-20-40-115-93(105)106)126-76(142)59(121-52(3)137)30-18-38-113-91(101)102;3-2(4,5)1(6)7/h11-12,25-26,46-47,50-51,53,58-69,72-74,118,136H,7-10,13-24,27-45,48-49,97-98H2,1-6H3,(H,111,120)(H,119,141)(H,121,137)(H,122,138)(H,123,146)(H,124,143)(H,125,144)(H,126,142)(H,127,145)(H,128,147)(H,129,149)(H,130,152)(H,131,153)(H,132,148)(H,133,150)(H,134,154)(H,135,151)(H,139,140)(H,155,156)(H4,99,100,112)(H4,101,102,113)(H4,103,104,114)(H4,105,106,115)(H4,107,108,116)(H4,109,110,117);(H,6,7)/t51-,58+,59+,60+,61-,62+,63-,64-,65+,66-,67-,68-,69-,72-,73-,74+;/m0./s1
Inchi Key RMHFOFDMWDLKCE-CEIWRPBYSA-N
SMILES OC(C(F)(F)F)=O.N=C(N)NCCC[C@@H](NC(C)=O)C(N[C@@H](CCCNC(N)=N)C(N[C@H](CCCNC(N)=N)C(NCC(N[C@H](CCCNC(N)=N)C(N[C@@H](CCCCN)C(N[C@H](CCCCN)C(N[C@@H](CCCNC(N)=N)C(N[C@H](CCCNC(N)=N)C(N[C@@H](CO)C(N[C@@H](CC1=CN=CN1)C(N[C@H](C(N[C@@H](C(C)(C)C)C(N[C@@H](C2CCCCC2)C(N[C@@H](CC(O)=O)C(N[C@H](C(O)=O)[C@@H](C)CC)=O)=O)=O)=O)CC3=CNC4=CC=CC=C34)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O
Size 1 mg
Supplier Page https://www.caymanchem.com/product/36984