Therapeutic Targets Database
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TTD Drug ID: DNC013067

Drug Information
Name[Dcp1]Dyn A(1-11)-NH2
IndicationNot AvailableExperimental    
Structure

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InChI1S/C75H117N23O14/c1-7-43(4)62(71(111)95-54(22-15-33-87-75(83)84)7
2(112)98-34-16-23-58(98)70(110)92-51(64(78)104)19-11-12-30-76)97-
67(107)53(21-14-32-86-74(81)82)93-66(106)52(20-13-31-85-73(79)80)
94-68(108)55(35-42(2)3)96-69(109)57(38-46-17-9-8-10-18-46)91-61(1
02)41-88-60(101)40-89-65(105)56(39-47-24-26-49(99)27-25-47)90-59(
100)29-28-50-44(5)36-48(63(77)103)37-45(50)6/h8-10,17-18,24-27,36
-37,42-43,51-58,62,99H,7,11-16,19-23,28-35,38-41,76H2,1-6H3,(H2,7
7,103)(H2,78,104)(H,88,101)(H,89,105)(H,90,100)(H,91,102)(H,92,11
0)(H,93,106)(H,94,108)(H,95,111)(H,96,109)(H,97,107)(H4,79,80,85)
(H4,81,82,86)(H4,83,84,87)/t43-,51-,52-,53-,54-,55-,56-,57-,58-,6
2-/m0/s1
InChIKeyYPSMIMXFFGKHRC-DJQAJQEISA-N
Canonical SMILESCCC(C)C(C(=O)NC(CCCN=C(N)N)C(=O)N1CCCC1C(=O)NC(CCCCN)C(=O)N)NC(=O)C
(CCCN=C(N)N)NC(=O)C(CCCN=C(N)N)NC(=O)C(CC(C)C)NC(=O)C(CC2=CC=CC=C2)NC(=
O)CNC(=O)CNC(=O)C(CC3=CC=C(C=C3)O)NC(=O)CCC4=C(C=C(C=C4C)C(=O)N)C    
Isomeric SMILESCC[C@H](C)[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H]
(CCCCN)C(=O)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H]
(CC(C)C)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)CNC(=O)CNC(=O)[C@H](CC3=CC=C(C=
C3)O)NC(=O)CCC4=C(C=C(C=C4C)C(=O)N)C
TargetDelta opioid receptorInhibitor[1]
Kappa opioid receptorInhibitor[1]
Mu opioid receptorInhibitor[1]
Ref 1J Med Chem. 2006 Aug 24;49(17):5382-5.Replacement of the N-terminal tyrosine residue in opioid peptides with 3-(2,6-dimethyl-4-carbamoylphenyl)propanoic acid (Dcp) results in novel opioid antagonists. To Reference



 

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