REMIKIREN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C33H50N4O6S
Molecular Weight	630.838
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)(C)S(=O)(=O)C[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CNC=N2)C(=O)N[C@@H](CC3CCCCC3)[C@@H](O)[C@@H](O)C4CC4

InChI

InChIKey=UXIGZRQVLGFTOU-VQXQMPIVSA-N

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

HIDE SMILES / InChI

Molecular Formula	C33H50N4O6S
Molecular Weight	630.838
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/22193701 | https://www.ncbi.nlm.nih.gov/pubmed/8498974 | https://adisinsight.springer.com/drugs/800001789

Remikiren (Ro 42-5892) is a very potent renin inhibitor in vitro and in vivo. Clinical results show that remikiren is a potent orally active renin inhibitor inducing a long lasting blood pressure decrease. Remikiren development has been discontinued.

Originator

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Renin 7 Target ID: P00797 Gene ID: 5972.0 Gene Symbol: REN Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/8498974	Inhibitor 8504		0.7 nM [IC50]

PubMed

Title	Date	PubMed
Role of aliskiren in cardio-renal protection and use in hypertensives with multiple risk factors.	2009	19475781
Purification and characterization of recombinant human renin for X-ray crystallization studies.	2008-06-26	18582379
Newly developed renin and prorenin assays and the clinical evaluation of renin inhibitors.	2008-05	18398335
Renin inhibition with aliskiren in hypertension: focus on aliskiren/hydrochlorothiazide combination therapy.	2008	19337534
The renin angiotensin system in the development of cardiovascular disease: role of aliskiren in risk reduction.	2008	19183745
Aliskiren--an orally active renin inhibitor. Review of pharmacology, pharmacodynamics, kinetics, and clinical potential in the treatment of hypertension.	2007	18200801
Functional expression of the renin-angiotensin system in human podocytes.	2006-03	16189286
Aliskiren, a novel, orally effective renin inhibitor, lowers blood pressure in marmosets and spontaneously hypertensive rats.	2005-02	15662231
Triple quadrupole linear ion trap mass spectrometer for the analysis of small molecules and macromolecules.	2004-08	15329837
Renin and angiotensinogen expression and functions in growth and apoptosis of human glioblastoma.	2004-03-08	14997208
Rapid screening and characterization of drug metabolites using a new quadrupole-linear ion trap mass spectrometer.	2003-02	12577280
The power of visual imagery in synthesis planning. Stereocontrolled approaches to CGP-60536B, a potent renin inhibitor.	2002-06-14	12054962
Distribution of remikiren, a potent orally active inhibitor of human renin, in laboratory animals.	1996-03	8730917
Discovery of remikiren as the first orally active renin inhibitor.	1993-02	8498974

Sample Use Guides

In Vivo Use Guide

Patients with essential hypertension: 600 mg orally for 8 days

Route of Administration: Oral

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:17:07 GMT 2025` Edited by `admin` on `Mon Mar 31 18:17:07 GMT 2025`
Record UNII	LC7FBL96A4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1H-Imidazole-5-propanamide, N-[(1S,2R,3S)-1-(cyclohexylmethyl)-3-cyclopropyl-2,3-dihydroxypropyl]-?-[[(2S)-2-[[(1,1-dimethylethyl)sulfonyl]methyl]-1-oxo-3-phenylpropyl]amino]-, (?S)-

Preferred Name

English

REMIKIREN

Official Name

English

remikiren [INN]

Common Name

English

REMIKIREN [MART.]

Common Name

English

Remikiren [WHO-DD]

Common Name

English

(?S)-N-[(1S,2R,3S)-1-(Cyclohexylmethyl)-3-cyclopropyl-2,3-dihydroxypropyl]-?-[[(2S)-2-[[(1,1-dimethylethyl)sulfonyl]methyl]-1-oxo-3-phenylpropyl]amino]-1H-imidazole-5-propanamide

Systematic Name

English

RO-42-5892

Code

English

REMIKIREN [USAN]

Common Name

English

RO 42-5892

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C783