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Substance Name: Choline, iodide, 2-phenylbutyrate (ester)
RN: 3482-90-4
InChIKey: WEHBLBNUZNADNR-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H24-N-O2.I

Molecular Weight

  • 377.26
 
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Names and Synonyms

Synonyms

  • Iodure de N-(phenyl-2-ethyl-2-acetylcholine)
  • Iodure de N-(phenyl-2-ethyl-2-acetylcholine) [French]
  • PEAC

Systematic Name

  • Choline, iodide, 2-phenylbutyrate (ester)

Registry Numbers

CAS Registry Number

  • 3482-90-4

System Generated Number

  • 0003482904

Molecular Formulas

Molecular Formula

  • C15-H24-N-O2.I

Molecular Formula Fragments

  • C15-H24-N-O2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C15H24NO2.HI/c1-5-14(13-9-7-6-8-10-13)15(17)18-12-11-16(2,3)4;/h6-10,14H,5,11-12H2,1-4H3;1H/q+1;/p-1

InChIKey

WEHBLBNUZNADNR-UHFFFAOYSA-M

Smiles

C(COC([C@@H](CC)c1ccccc1)=O)[N+](C)(C)C.[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 9mg/kg (9mg/kg) AUTONOMIC NERVOUS SYSTEM: GANGLION FACILITANT Chimica Therapeutica. Vol. 1, Pg. 46, 1965.