CLOPROSTENOL SODIUM, (+)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H28ClO6.Na
Molecular Weight	446.897
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].O[C@@H](COC1=CC=CC(Cl)=C1)\C=C\[C@H]2[C@H](O)C[C@H](O)[C@@H]2C\C=C/CCCC([O-])=O

InChI

InChIKey=IFEJLMHZNQJGQU-KXXGZHCCSA-M

InChI=1S/C22H29ClO6.Na/c23-15-6-5-7-17(12-15)29-14-16(24)10-11-19-18(20(25)13-21(19)26)8-3-1-2-4-9-22(27)28;/h1,3,5-7,10-12,16,18-21,24-26H,2,4,8-9,13-14H2,(H,27,28);/q;+1/p-1/b3-1-,11-10+;/t16-,18-,19-,20+,21-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

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

Molecular Formula	C22H28ClO6
Molecular Weight	423.907
Charge	-1
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 02:52:49 UTC 2023` Edited by `admin` on `Sat Dec 16 02:52:49 UTC 2023`
Record UNII	81129I41BJ
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

CLOPROSTENOL SODIUM, (+)-

Common Name

English

(+)-CLOPROSTENOL SODIUM

Common Name

English

D-CLOPROSTENOL SODIUM SALT

Common Name

English

(+)-CLOPROSTENOL (SODIUM SALT)

Common Name

English

5-HEPTENOIC ACID, 7-((1R,2R,3R,5S)-2-((1E,3R)-4-(3-CHLOROPHENOXY)-3-HYDROXY-1-BUTEN-1-YL)-3,5-DIHYDROXYCYCLOPENTYL)-, SODIUM SALT (1:1), (5Z)-

Common Name

English

Code System Code Type Description

PUBCHEM

17756794

Created by admin on Sat Dec 16 02:52:50 UTC 2023 , Edited by admin on Sat Dec 16 02:52:50 UTC 2023

PRIMARY

CAS

62561-03-9

Created by admin on Sat Dec 16 02:52:49 UTC 2023 , Edited by admin on Sat Dec 16 02:52:49 UTC 2023

PRIMARY

SMS_ID

100000166894

Created by admin on Sat Dec 16 02:52:50 UTC 2023 , Edited by admin on Sat Dec 16 02:52:50 UTC 2023

PRIMARY

FDA UNII

81129I41BJ

Created by admin on Sat Dec 16 02:52:50 UTC 2023 , Edited by admin on Sat Dec 16 02:52:50 UTC 2023

PRIMARY

EVMPD

SUB181183

Created by admin on Sat Dec 16 02:52:50 UTC 2023 , Edited by admin on Sat Dec 16 02:52:50 UTC 2023

PRIMARY

Related Record Type Details


					52EJR3Y9IN

CLOPROSTENOL, (+)-

PARENT -> SALT/SOLVATE

Related Record Type Details


					52EJR3Y9IN

CLOPROSTENOL, (+)-

ACTIVE MOIETY