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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H39ClO5
Molecular Weight 431.006
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of AL-6598

SMILES

CC(C)OC(=O)COC\C=C/C[C@H]1[C@H](Cl)C[C@@H](O)[C@@H]1CC[C@@H](O)C2CCCCC2

InChI

InChIKey=GXLUEHGRKZQLOO-QMAHXAMHSA-N
InChI=1S/C23H39ClO5/c1-16(2)29-23(27)15-28-13-7-6-10-18-19(22(26)14-20(18)24)11-12-21(25)17-8-4-3-5-9-17/h6-7,16-22,25-26H,3-5,8-15H2,1-2H3/b7-6-/t18-,19-,20-,21-,22-/m1/s1

HIDE SMILES / InChI

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
3.2 µM [Ki]
Name Type Language
AL-6598
Code English
ACETIC ACID, (((2Z)-4-((1R,2R,3R,5R)-5-CHLORO-2-((3R)-3-CYCLOHEXYL-3-HYDROXYPROPYL)-3-HYDROXYCYCLOPENTYL)-2-BUTENYL)OXY)-, 1-METHYLETHYL ESTER
Systematic Name English
ACETIC ACID, ((4-(5-CHLORO-2-(3-CYCLOHEXYL-3-HYDROXYPROPYL)-3-HYDROXYCYCLOPENTYL)-2-BUTENYL)OXY)-, 1-METHYLETHYL ESTER, (1R-(1.ALPHA.(Z),2.BETA.(R*),3.ALPHA.,5.BETA.))-
Systematic Name English
9-CHLORO-15-CYCLOHEXYL-11,15-DIHYDRO-3-OXA-16,17,18,19,20-PENTANOR-PROSTENOIC ACID ISOPROPYL ESTER (5Z,9R,11R,15R)
Systematic Name English
Code System Code Type Description
FDA UNII
XE6G6DQ45F
Created by admin on Fri Dec 15 15:37:26 GMT 2023 , Edited by admin on Fri Dec 15 15:37:26 GMT 2023
PRIMARY
MANUFACTURER PRODUCT INFORMATION
AL-6598
Created by admin on Fri Dec 15 15:37:26 GMT 2023 , Edited by admin on Fri Dec 15 15:37:26 GMT 2023
PRIMARY Elevated intraocular pressure (IOP) is an important risk factor in developing glaucoma. Certain prostaglandins such as PGF2.ALPHA. and PGD2, have been shown to reduce IOP. AL 6598 is the isopropyl ester prodrug of AL 6556, a PGD2 receptor agonist that binds to DP receptors with a Ki value of 3.2 undefined M and demonstrates an EC50 value of 0.80 undefinedM in an in vitro functional assay. Designed to enhance corneal absorption, AL 6598 produces a maximum 53% drop in IOP of the ocular hypertensive monkey with a 1 undefinedg dose given twice daily.
PUBCHEM
9832594
Created by admin on Fri Dec 15 15:37:26 GMT 2023 , Edited by admin on Fri Dec 15 15:37:26 GMT 2023
PRIMARY
CAS
170291-06-2
Created by admin on Fri Dec 15 15:37:26 GMT 2023 , Edited by admin on Fri Dec 15 15:37:26 GMT 2023
PRIMARY