Drug Information

Drug General Information
Drug ID
D04DZP
Former ID
DNC003617
Drug Name
(H-261)Boc-His-Pro-Phe-His-Leu(OH)-Val-Ile-His-OH
Indication Discovery agent Investigative [533442]
Structure
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2D MOL

3D MOL
Formula
C54H80N14O11
Canonical SMILES
CCC(C)C(C(=O)NC(CC1=CN=CN1)C(=O)O)NC(=O)C(C(C)C)NC(C(CC<br />(C)C)NC(=O)C(CC2=CN=CN2)NC(=O)C(CC3=CC=CC=C3)NC(=O)C4CC<br />CN4C(=O)C(CC5=CN=CN5)NC(=O)OC(C)(C)C)O
InChI
1S/C54H80N14O11/c1-10-32(6)44(50(74)64-41(52(76)77)23-36-26-57-29-60-36)67-49(73)43(31(4)5)66-47(71)37(19-30(2)3)61-46(70)39(21-34-24-55-27-58-34)62-45(69)38(20-33-15-12-11-13-16-33)63-48(72)42-17-14-18-68(42)51(75)40(22-35-25-56-28-59-35)65-53(78)79-54(7,8)9/h11-13,15-16,24-32,37-44,47,66,71H,10,14,17-23H2,1-9H3,(H,55,58)(H,56,59)(H,57,60)(H,61,70)(H,62,69)(H,63,72)(H,64,74)(H,65,78)(H,67,73)(H,76,77)
InChIKey
UIOXZRLXAROYRL-UHFFFAOYSA-N
PubChem Compound ID
44293339
Target and Pathway
Target(s) Renin, renal Target Info Inhibitor [533442]
KEGG Pathway Renin-angiotensin system
PathWhiz Pathway Angiotensin Metabolism
Reactome Metabolism of Angiotensinogen to Angiotensins
WikiPathways ACE Inhibitor Pathway
Metabolism of Angiotensinogen to Angiotensins
References
Ref 533442J Med Chem. 1987 Oct;30(10):1729-37.Renin inhibitors. Dipeptide analogues of angiotensinogen incorporating transition-state, nonpeptidic replacements at the scissile bond.
Ref 533442J Med Chem. 1987 Oct;30(10):1729-37.Renin inhibitors. Dipeptide analogues of angiotensinogen incorporating transition-state, nonpeptidic replacements at the scissile bond.

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