TTD Drug ID: DNC005148

Drug Information
Name	des-Arg10-Leu9-Kallidin
Indication	Not Available			Experimental
Structure	Click to save drug structure in 3D MOL format Click to save drug structure in 2D MOL format
InChI	1S/C47H75N13O11/c1-28(2)24-33(46(70)71)56-42(66)36-17-10-21-58(36 )44(68)34(27-61)57-40(64)32(25-29-12-4-3-5-13-29)54-38(62)26-53-4 1(65)35-16-9-22-59(35)45(69)37-18-11-23-60(37)43(67)31(15-8-20-52 -47(50)51)55-39(63)30(49)14-6-7-19-48/h3-5,12-13,28,30-37,61H,6-1 1,14-27,48-49H2,1-2H3,(H,53,65)(H,54,62)(H,55,63)(H,56,66)(H,57,6 4)(H,70,71)(H4,50,51,52)/t30-,31-,32-,33-,34-,35-,36-,37-/m0/s1
InChIKey	AGTPZUQKOYEAOH-MDKUUQCZSA-N
Canonical SMILES	CC(C)CC(C(=O)O)NC(=O)C1CCCN1C(=O)C(CO)NC(=O)C(CC2=CC=CC=C2)NC(=O)CNC(=O) C3CCCN3C(=O)C4CCCN4C(=O)C(CCCN=C(N)N)NC(=O)C(CCCCN)N
Isomeric SMILES	CC(C)C[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC2=CC= CC=C2)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H]4CCCN4C(=O)[C@H](CCCN=C(N)N)NC (=O)[C@H](CCCCN)N
Target	Bradykinin B1 receptor			Inhibitor	[1]
Ref 1	Bioorg Med Chem Lett. 2004 Dec 20;14(24):6045-8.Development of an efficient and selective radioligand for bradykinin B1 receptor occupancy studies. To Reference

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