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Substance Name: Remiprostol, (1R,2R,3R,4'S)-(+/-)-
RN: 110903-34-9
UNII: AA18Q847DF
InChIKey: ZZVPHCPLTZTOBC-VWMJZDBTSA-N

Molecular Formula

  • C25-H36-O5

Molecular Weight

  • 416.5544
 
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Names and Synonyms

Name of Substance

  • Remiprostol, (1R,2R,3R,4'S)-(+/-)-

Synonyms

  • 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-
  • 4-Heptenoic acid, 7-(2-(6-(1-cyclopenten-1-yl)-4-hydroxy-4-methyl-1,5-hexadienyl)-3-hydroxy-5-oxocyclopentyl)-, methyl ester, (1alpha(Z),2beta(1E,4S*,5E),3alpha)-(+/-)-
  • Remiprostol, (1R,2R,3R,4'S)-(+/-)-
  • Remiprostol, (1S,2S,3S,4'R)-(+/-)-
  • UNII-AA18Q847DF

Registry Numbers

CAS Registry Number

  • 110903-34-9

FDA UNII

  • AA18Q847DF

System Generated Number

  • 0110903349

Structure Descriptors

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

InChIKey

ZZVPHCPLTZTOBC-VWMJZDBTSA-N

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