Drug Information

Drug General Information
Drug ID
D0J6QC
Former ID
DNC004093
Drug Name
PP1-Pro-Phe-N-MeHis-LVA-Ile-Amp-(O)
Drug Type
Small molecular drug
Indication Discovery agent Investigative [530554]
Structure
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2D MOL

3D MOL
Formula
C47H70N9O12P
Canonical SMILES
CCC(C)C(C(=O)NCC1=CC=CC=[N+]1[O-])NC(=O)C(CC(C(CC(C)C)N<br />C(=O)C(CC2=CN=CN2)N(C)C(=O)C(CC3=CC=CC=C3)NC(=O)C4CCCN4<br />C(=O)COP(=O)(O)O)O)C(C)C
InChI
1S/C47H70N9O12P/c1-8-31(6)42(46(62)49-26-34-17-12-13-20-56(34)64)53-43(59)35(30(4)5)24-40(57)36(21-29(2)3)51-45(61)39(23-33-25-48-28-50-33)54(7)47(63)37(22-32-15-10-9-11-16-32)52-44(60)38-18-14-19-55(38)41(58)27-68-69(65,66)67/h9-13,15-17,20,25,28-31,35-40,42,57H,8,14,18-19,21-24,26-27H2,1-7H3,(H,48,50)(H,49,62)(H,51,61)(H,52,60)(H,53,59)(H2,65,66,67)
InChIKey
APMOVMFBSHFCLN-UHFFFAOYSA-N
PubChem Compound ID
14803041
Target and Pathway
Target(s) Renin, renal Target Info Inhibitor [530554]
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 530554J Med Chem. 1991 Feb;34(2):633-42.Renin inhibitory peptides. Incorporation of polar, hydrophilic end groups into an active renin inhibitory peptide template and their evaluation in a human renin infused rat model and in conscious sodium-depleted monkeys.
Ref 530554J Med Chem. 1991 Feb;34(2):633-42.Renin inhibitory peptides. Incorporation of polar, hydrophilic end groups into an active renin inhibitory peptide template and their evaluation in a human renin infused rat model and in conscious sodium-depleted monkeys.

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