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Substance Name: Taprostene sodium salt
RN: 87440-45-7
UNII: 3M078713KZ
InChIKey: KPQVOJYDUCZQEQ-REHYUDDHSA-M

Classification Code

  • Cardiovascular Agents

Molecular Formula

  • C24-H30-O5.Na

Molecular Weight

  • 420.4781
 
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Names and Synonyms

Name of Substance

  • Taprostene
  • Taprostene sodium salt

Synonyms

  • 2,3,4-Trinor-1,5-inter-2-phenylene-6,9-epoxy-11,15-dihydroxy-15-dihydroxy-15-cyclohexyl-(16,17,18,19,20-pentanor)prosta-5,13-dienoate
  • CG 4203
  • Sodium 2,3,4-trinor-1,5-2-phenylene-6,9-epoxy-11,15-dihydroxy-15-cyclohexyl-(16,17,18,19,20-pentanor)prosta-5,13-dienoate
  • UNII-3M078713KZ

Systematic Names

  • Benzoic acid, 3-((4-(3-cyclohexyl-3-hydroxy-1-propenyl)hexahydro-5-hydroxy-2H-cyclopenta(b)furan-2-ylidene)methyl)-, monosodium salt, (3aR-(2Z,3aalpha,4alpha(1E,3S*),5beta,6aalpha))-
  • Benzoic acid, 3-((Z)-((3aR,4R,5R,6aS)-(4-((1E,3S)-3-cyclohexyl-3-hydroxy-1-propenyl)hexahydro-5-hydroxy-2H-cyclopenta(b)furan-2-ylidene)methyl)-, monosodium salt

Registry Numbers

CAS Registry Number

  • 87440-45-7

FDA UNII

  • 3M078713KZ

System Generated Number

  • 0087440457

Molecular Formulas

Molecular Formula

  • C24-H30-O5.Na

Molecular Formula Fragments

  • C24-H30-O5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C24H30O5.Na/c25-21(16-6-2-1-3-7-16)10-9-19-20-13-18(29-23(20)14-22(19)26)12-15-5-4-8-17(11-15)24(27)28;/h4-5,8-12,16,19-23,25-26H,1-3,6-7,13-14H2,(H,27,28);/q;+1/p-1/b10-9+,18-12-;/t19-,20-,21-,22-,23+;/m1./s1

InChIKey

KPQVOJYDUCZQEQ-REHYUDDHSA-M

Smiles

c1cc(cc(c1)C(=O)[O-])/C=C\2/C[C@H]3[C@@H](O2)C[C@H]([C@@H]3/C=C/[C@H](C4CCCCC4)O)O.[Na+]