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Details

Stereochemistry RACEMIC
Molecular Formula C25H36O5
Molecular Weight 416.5503
Optical Activity ( + / - )
Defined Stereocenters 4 / 4
E/Z Centers 3
Charge 0

SHOW SMILES / InChI
Structure of REMIPROSTOL, (1R,2R,3R,4'S)-(±)-

SMILES

COC(=O)CC\C=C/CC[C@@H]1[C@@H](\C=C\C[C@](C)(O)\C=C\C2=CCCC2)[C@H](O)CC1=O

InChI

InChIKey=ZZVPHCPLTZTOBC-VWMJZDBTSA-N
InChI=1S/C25H36O5/c1-25(29,17-15-19-10-7-8-11-19)16-9-13-21-20(22(26)18-23(21)27)12-5-3-4-6-14-24(28)30-2/h3-4,9-10,13,15,17,20-21,23,27,29H,5-8,11-12,14,16,18H2,1-2H3/b4-3-,13-9+,17-15+/t20-,21-,23-,25+/m1/s1

HIDE SMILES / InChI

Molecular Formula C25H36O5
Molecular Weight 416.5503
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 3
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 16:25:33 GMT 2025
Edited
by admin
on Tue Apr 01 16:25:33 GMT 2025
Record UNII
AA18Q847DF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
REMIPROSTOL, (1S,2S,3S,4'R)-(±)-
Preferred Name English
REMIPROSTOL, (1R,2R,3R,4'S)-(±)-
Common Name English
4-HEPTENOIC ACID, 7-(2-(6-(1-CYCLOPENTEN-1-YL)-4-HYDROXY-4-METHYL-1,5-HEXADIENYL)-3-HYDROXY-5-OXOCYCLOPENTYL)-, METHYL ESTER, (1.ALPHA.(Z),2.BETA.(1E,4S*,5E),3.ALPHA.)-(±)-
Systematic Name English
4-HEPTENOIC ACID, 7-((1R,2R,3R)-2-((1E,4S,5E)-6-(1-CYCLOPENTEN-1-YL)-4-HYDROXY-4-METHYL-1,5-HEXADIEN-1-YL)-3-HYDROXY-5-OXOCYCLOPENTYL)-, METHYL ESTER, (4Z)-REL-
Systematic Name English
Code System Code Type Description
PUBCHEM
13935285
Created by admin on Tue Apr 01 16:25:33 GMT 2025 , Edited by admin on Tue Apr 01 16:25:33 GMT 2025
PRIMARY
CAS
110903-34-9
Created by admin on Tue Apr 01 16:25:33 GMT 2025 , Edited by admin on Tue Apr 01 16:25:33 GMT 2025
PRIMARY
FDA UNII
AA18Q847DF
Created by admin on Tue Apr 01 16:25:33 GMT 2025 , Edited by admin on Tue Apr 01 16:25:33 GMT 2025
PRIMARY