CAS 1393680-45-9

Formula: C77H118N26O25S3

InChI: InChI=1S/C77H118N26O25S3/c1-36(2)60-74(128)98-49(24-58(111)112)69(123)102-54-35-131-32-42-21-40(30-129-33-52(65(119)90-27-59(113)114)101-62(116)38(4)91-70(124)50(28-104)93-56(108)26-88-63(117)44(8-5-17-85-75(79)80)92-55(107)25-89-64(118)45(94-72(54)126)9-6-18-86-76(81)82)20-41(22-42)31-130-34-53(100-61(115)37(3)78)73(127)99-51(29-105)71(125)95-46(10-7-19-87-77(83)84)66(120)97-48(23-39-11-13-43(106)14-12-39)68(122)96-47(67(121)103-60)15-16-57(109)110/h11-14,20-22,36-38,44-54,60,104-106H,5-10,15-19,23-35,78H2,1-4H3,(H,88,117)(H,89,118)(H,90,119)(H,91,124)(H,92,107)(H,93,108)(H,94,126)(H,95,125)(H,96,122)(H,97,120)(H,98,128)(H,99,127)(H,100,115)(H,101,116)(H,102,123)(H,103,121)(H,109,110)(H,111,112)(H,113,114)(H4,79,80,85)(H4,81,82,86)(H4,83,84,87)/t37-,38-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,60-/m0/s1

InChI key: KYNBQUMODKZUIJ-UDZSBARMSA-N

SMILES: C[C@H]1C(=O)N[C@@H](CSCC2=CC3=CC(=C2)CSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSC3)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1)CO)CCCNC(=N)N)CCCNC(=N)N)CC(=O)O)C(C)C)CCC(=O)O)CC4=CC=C(C=C4)O)CCCNC(=N)N)CO)NC(=O)[C@H](C)N)C(=O)NCC(=O)O

Bicyclic UK18

CAS: 1393680-45-9

Bicyclic UK18 is a competitive inhibitor of human urokinase-type plasminogen activator (uPA) with a Ki value of 53 nM.

Formula: C₇₇H₁₁₈N₂₆O₂₅S₃

Color and Shape: Solid

Molecular weight: 1904.11

Ref: TM-TP3037