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Substance Name: 2-Furanpropionic acid, tetrahydro-alpha-(1-naphthylmethyl)-, 2-piperidinoethyl ester, oxalate (1:1)
RN: 3209-95-8
InChIKey: QUJSVBSYVNCXBP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H33-N-O3.C2-H2-O4

Molecular Weight

  • 485.573
 
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Names and Synonyms

Synonym

  • alpha-(1-Naphthylmethyl)tetrahydro-2-furanpropionic acid 2-piperidinoethyl ester oxalate

Systematic Name

  • 2-Furanpropionic acid, tetrahydro-alpha-(1-naphthylmethyl)-, 2-piperidinoethyl ester, oxalate (1:1)

Registry Numbers

CAS Registry Number

  • 3209-95-8

System Generated Number

  • 0003209958

Molecular Formulas

Molecular Formula

  • C25-H33-N-O3.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C25-H33-N-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C25H33NO3.C2H2O4/c27-25(29-17-15-26-13-4-1-5-14-26)22(19-23-11-7-16-28-23)18-21-10-6-9-20-8-2-3-12-24(20)21;3-1(4)2(5)6/h2-3,6,8-10,12,22-23H,1,4-5,7,11,13-19H2;(H,3,4)(H,5,6)

InChIKey

QUJSVBSYVNCXBP-UHFFFAOYSA-N

Smiles

c12c(C[C@@H](C[C@@H]3CCCO3)C(OCC[NH+]3CCCCC3)=O)cccc1cccc2.C(C(=O)[O-])(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 35mg/kg (35mg/kg)   Comptes Rendus des Seances de l'Academie des Sciences, Serie D: Sciences Naturelles. Vol. 262, Pg. 719, 1966.