CIPROSTENE CALCIUM

Details

Stereochemistry	ABSOLUTE
Molecular Formula	2C22H35O4.Ca
Molecular Weight	767.1
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	4
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Ca++].[H][C@]12C\C(C[C@@]1(C)C[C@@H](O)[C@@H]2\C=C\[C@@H](O)CCCCC)=C\CCCC([O-])=O.[H][C@]34C\C(C[C@@]3(C)C[C@@H](O)[C@@H]4\C=C\[C@@H](O)CCCCC)=C\CCCC([O-])=O

InChI

InChIKey=NJTMVDAFPIEZAJ-BMKVUGPNSA-L

InChI=1S/2C22H36O4.Ca/c2*1-3-4-5-9-17(23)11-12-18-19-13-16(8-6-7-10-21(25)26)14-22(19,2)15-20(18)24;/h2*8,11-12,17-20,23-24H,3-7,9-10,13-15H2,1-2H3,(H,25,26);/q;;+2/p-2/b2*12-11+,16-8-;/t2*17-,18+,19+,20+,22-;/m00./s1

HIDE SMILES / InChI

Molecular Formula	Ca
Molecular Weight	40.078
Charge	2
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C22H35O4
Molecular Weight	363.5109
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	2
Optical Activity	UNSPECIFIED

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/3068680 | https://www.ncbi.nlm.nih.gov/pubmed/3896365 | https://www.ncbi.nlm.nih.gov/pubmed/1632305

Ciprostene is a synthetic, chemically stable analog of prostacyclin (PGI2). In animal models, administration of ciprostene resulted in dose-dependent hypotension, tachycardia, and inhibition of ex vivo ADP-induced platelet aggregation. Ciprostene was evaluated in clinical trials in patients with peripheral vascular disease. It was found to reduce restenosis in patients with coronary artery disease undergoing therapeutic percutaneous transluminal coronary angioplasty.

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Prostanoid IP receptor 18 Target ID: CHEMBL1995 Sources: https://www.ncbi.nlm.nih.gov/pubmed/21129424 \| https://www.ncbi.nlm.nih.gov/pubmed/3005377	Agonist 2678

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:16:37 GMT 2023` Edited by `admin` on `Fri Dec 15 15:16:37 GMT 2023`
Record UNII	A85Y5Y98EJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CIPROSTENE CALCIUM

Official Name

English

U-61,431F

Code

English

CALCIUM (Z)-(3AS,5R,6R,6AR)-HEXAHYDRO-5-HYDROXY-6-((E)-(3S)-3-HYDROXY-1-OCTENYL)-3A-METHYL-.DELTA.(SUP 2)(1H),.DELTA.-PENTALENEVALERATE (1:2)

Common Name

English

CIPROSTENE CALCIUM [MART.]

Common Name

English

CIPROSTENE CALCIUM [USAN]

Common Name

English

U-61431F

Code

English

Code System Code Type Description

NCI_THESAURUS

C171867