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Substance Name: Pseudococaine tartrate
RN: 1176-03-0
UNII: 1O0S7ZUF73
InChIKey: MRJHQVZNBKASQN-GASYBUPXSA-N

Molecular Formula

  • C17-H21-N-O4.C4-H6-O6

Molecular Weight

  • 453.4413
 
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Names and Synonyms

Name of Substance

  • Pseudococaine tartrate

Synonyms

  • 2-alpha-Carbomethoxy-3-beta-benzoxytropane tartrate
  • d-Cocaine tartrate
  • Delcaine tartrate
  • EINECS 214-643-1
  • Isococaine tartrate
  • Pseudocaine bitartrate
  • Pseudocaine, tartrate (1:1)
  • Psicaine
  • UNII-1O0S7ZUF73

Systematic Names

  • (1R-(2-endo,3-exo))-3-(Benzoyloxy)-2-(methoxycarbonyl)-8-methyl-8-azoniabicyclo(3.2.1)octane hydrogen (R-(R*,R*))-tartrate
  • Pseudococaine, tartate

Registry Numbers

CAS Registry Number

  • 1176-03-0

FDA UNII

  • 1O0S7ZUF73

System Generated Number

  • 0001176030

Molecular Formulas

Molecular Formula

  • C17-H21-N-O4.C4-H6-O6

Molecular Formula Fragments

  • C17-H21-N-O4
  • C4-H6-O6
  • COMPONENT

Structure Descriptors

InChI

1S/C17H21NO4.C4H6O6/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11;5-1(3(7)8)2(6)4(9)10/h3-7,12-15H,8-10H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10)/t12-,13+,14-,15-;1-,2-/m01/s1

InChIKey

MRJHQVZNBKASQN-GASYBUPXSA-N

Smiles

CN1[C@H]2CC[C@@H]1[C@@H]([C@H](C2)OC(=O)c3ccccc3)C(=O)OC.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LDLo intravenous 15mg/kg (15mg/kg)   "Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1289, 1935.
cat LDLo subcutaneous 60mg/kg (60mg/kg)   "Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1289, 1935.
guinea pig LDLo intraperitoneal 200mg/kg (200mg/kg)   Physiological Reviews. Vol. 12, Pg. 190, 1932.
guinea pig LDLo intravenous 20mg/kg (20mg/kg)   Physiological Reviews. Vol. 12, Pg. 190, 1932.
guinea pig LDLo subcutaneous 95mg/kg (95mg/kg)   Physiological Reviews. Vol. 12, Pg. 190, 1932.
mouse LDLo intravenous 26mg/kg (26mg/kg) BEHAVIORAL: GENERAL ANESTHETIC "Vergleichend-pharmakologische Untersuchungen ueber die haemolytische Wirkung und die Toxizitat der Lokalanaesthetika, Dissertation," Walther, M., Pharmakologischen Instit Martin Luther-Universitat Halle-Wittenburg, Ger. Dem. Rep., 1936Vol. -, Pg. -, 1936.
mouse LDLo subcutaneous 330mg/kg (330mg/kg)   Physiological Reviews. Vol. 12, Pg. 190, 1932.
rat LDLo intravenous 30mg/kg (30mg/kg)   Physiological Reviews. Vol. 12, Pg. 190, 1932.