An L-histidine derivative that is L-histidine in which one of the amino hydrogens is replaced by a (2S)-2-[(2-methylpropane-2-sulfonyl)methyl]-3-phenylpropanoyl group and the carboxy group is replaced by a [(2S,3R,4S)-1-cyclohexyl-4-cyclopropyl-3,4-dihydroxybutan-2-yl]amino group. It is a renin inhibitor which was under development for the treatment of hypertension (now discontinued).
class Information
0
C33H50N4O6S
- CAS:126222-34-2
- Chemspider:4884377
- DrugBank:DB00212
- Drug_Central:4696
- HMDB:HMDB0014357
- KEGG:C07465
- KEGG:D09038
- PDBeChem:REM
- PMID:10809804
- PMID:1282588
- PMID:12959271
- PMID:1313478
- PMID:22193701
- PMID:26421414
- PMID:7564363
- PMID:7678159
- PMID:7692163
- PMID:7769797
- PMID:7795817
- PMID:8206619
- PMID:8207739
- PMID:8222499
- PMID:8228207
- PMID:8491068
- PMID:8498974
- PMID:8512659
- PMID:8730917
- PMID:8730924
- PMID:8730920
- PMID:8783774
- PMID:8851507
- PMID:9095095
- PMID:9172787
- Wikipedia:Remikiren
chebi_ontology
InChI=1S/C33H50N4O6S/c1-33(2,3)44(42,43)20-25(16-22-10-6-4-7-11-22)31(40)37-28(18-26-19-34-21-35-26)32(41)36-27(17-23-12-8-5-9-13-23)30(39)29(38)24-14-15-24/h4,6-7,10-11,19,21,23-25,27-30,38-39H,5,8-9,12-18,20H2,1-3H3,(H,34,35)(H,36,41)(H,37,40)/t25-,27+,28+,29+,30-/m1/s1
UXIGZRQVLGFTOU-VQXQMPIVSA-N
630.850
630.34511
CC(C)(C)S(=O)(=O)C[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CNC=N1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)C1CC1