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Substance Name: Sulprostone [USAN:INN]
RN: 60325-46-4
UNII: 501Q5EQ1GM
InChIKey: UQZVCDCIMBLVNR-TWYODKAFSA-N

Molecular Formula

  • C23-H31-N-O7-S

Molecular Weight

  • 465.564
 

Classification Codes

  • Abortifacient Agents
  • Abortifacient Agents, Nonsteroidal
  • Contraceptive Agents
  • Contraceptive Agents, Female
  • Drug / Therapeutic Agent
  • Hormone
  • Human Data
  • Menstruation-Inducing Agents
  • Prostaglandin
  • Reproductive Control Agents
  • Reproductive Effect
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Names and Synonyms

Name of Substance

  • Sulprostone
  • Sulprostone [USAN:INN]

Synonyms

  • (Z)-7-((1R,2R,3R)-3-Hydroxy-2-((E)-(3R)-(3-hydroxy-4-phenoxy-1-butenyl))-5-oxocyclopentyl)-N-(methylsulfonyl)-5-heptenamide
  • 16-Phenoxy-17,18,19,20 tetranor prostaglandin E(sub 2) methyl sulfonylamide
  • 16-Phenoxy-omega-17,18,19,20-tetranor pge-2 methylsulfonylamide
  • 16-Phenoxy-omega-17,18,19,20-tetranor prostaglandin E2 methylsulfonylamide
  • 5-Heptenamide, 7-(3-hydroxy-2-(3-hydroxy-4-phenoxy-1-butenyl)-5-oxocyclopentyl)-N-(methylsulfonyl)-, (1R-(1a(Z),2b(1E,3R*),3a))-
  • 5-Heptenamide, 7-(3-hydroxy-2-(3-hydroxy-4-phenoxy-1-butenyl)-5-oxocyclopentyl)-N-(methylsulfonyl)-, (1R-(1alpha(Z),2beta(1E,3R*),3alpha))-
  • CP 34089
  • CP-34,089
  • EINECS 262-173-0
  • Nalador
  • SHB 286
  • Sulprostona
  • Sulprostona [INN-Spanish]
  • Sulprostone
  • Sulprostonum
  • Sulprostonum [INN-Latin]
  • UNII-501Q5EQ1GM
  • ZK 57 671
  • ZK 57671

Systematic Names

  • 5-Heptenamide, 7-(3-hydroxy-2-(3-hydroxy-4-phenoxy-1-butenyl)-5-oxocyclopentyl)-N-(methylsulfonyl)-, (1R-(1alpha(Z),2beta(1E,3R*),3alpha))-
  • Sulprostone

Registry Numbers

CAS Registry Number

  • 60325-46-4

FDA UNII

  • 501Q5EQ1GM

Related Registry Number

  • 96420-78-9 (unknown MF)

System Generated Number

  • 0060325464

Structure Descriptors

InChI

1S/C23H31NO7S/c1-32(29,30)24-23(28)12-8-3-2-7-11-19-20(22(27)15-21(19)26)14-13-17(25)16-31-18-9-5-4-6-10-18/h2,4-7,9-10,13-14,17,19-20,22,25,27H,3,8,11-12,15-16H2,1H3,(H,24,28)/b7-2-,14-13+/t17-,19-,20-,22-/m1/s1

InChIKey

UQZVCDCIMBLVNR-TWYODKAFSA-N

Smiles

C1[C@H]([C@@H]([C@H](C\C=C/CCCC(=O)NS(=O)(=O)C)C1=O)\C=C\[C@H](COc1ccccc1)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 18mg/kg (18mg/kg)   Eksperimental'naya i Klinicheskaya Farmakologiya. Experimental and Clinical Pharmacology. Vol. 56(4), Pg. 37, 1993.
rabbit LD50 intraperitoneal 3mg/kg (3mg/kg)   Eksperimental'naya i Klinicheskaya Farmakologiya. Experimental and Clinical Pharmacology. Vol. 56(4), Pg. 37, 1993.
rat LD50 intraperitoneal 12mg/kg (12mg/kg)   Eksperimental'naya i Klinicheskaya Farmakologiya. Experimental and Clinical Pharmacology. Vol. 56(4), Pg. 37, 1993.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.580 (none)   EST
Atmospheric OH Rate Constant 1.95E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.