Therapeutic Targets Database
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TTD Drug ID: DNC008093

Drug Information
Namec[CO-(CH2)3-CO-Pro-D-Nal(2)-Arg-Trp-Lys]-NH2
IndicationNot AvailableExperimental    
Structure

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InChI1S/C52H63N11O7/c53-46(65)40-18-7-8-24-56-25-10-21-45(64)37-15-3-4
-16-38(37)51(70)63-27-11-20-44(63)50(69)62-42(29-32-22-23-33-12-1
-2-13-34(33)28-32)48(67)60-41(19-9-26-57-52(54)55)47(66)61-43(49(
68)59-40)30-35-31-58-39-17-6-5-14-36(35)39/h1-6,12-17,22-23,28,31
,40-44,56,58H,7-11,18-21,24-27,29-30H2,(H2,53,65)(H,59,68)(H,60,6
7)(H,61,66)(H,62,69)(H4,54,55,57)/t40-,41-,42+,43-,44-/m0/s1
InChIKeyYUUZCRILYWDWPO-PURVKFDZSA-N
Canonical SMILESC1CCNCCCC(=O)C2=CC=CC=C2C(=O)N3CCCC3C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C1)C
(=O)N)CC4=CNC5=CC=CC=C54)CCCN=C(N)N)CC6=CC7=CC=CC=C7C=C6    
Isomeric SMILESC1CCNCCCC(=O)C2=CC=CC=C2C(=O)N3CCC[C@H]3C(=O)N[C@@H](C(=O)N[C@H](C(=O)N
[C@H](C(=O)N[C@@H](C1)C(=O)N)CC4=CNC5=CC=CC=C54)CCCN=C(N)N)CC6=CC7=CC=
CC=C7C=C6
TargetMelanocortin receptor 3Inhibitor[1]
Melanocortin receptor 4Inhibitor[1]
Melanocortin receptor 5Inhibitor[1]
Ref 1J Med Chem. 2008 Jan 24;51(2):187-95. Epub 2007 Dec 19.Structure-activity relationships of cyclic lactam analogues of alpha-melanocyte-stimulating hormone (alpha-MSH) targeting the human melanocortin-3 receptor. To Reference



 

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