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Substance Name: Phenethylamine, N-ethyl-N-(4-hydroxybutyl)-2-methoxy-alpha-methyl-, 3,4,5-trimethoxybenzoate
RN: 67293-28-1
InChIKey: GBEFJBUJDJXMSH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H37-N-O6

Molecular Weight

  • 459.5793
 
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Names and Synonyms

Synonyms

  • BRN 2793387
  • N-Ethyl-N-(4-hydroxybutyl)-2-methoxy-alpha-methylphenethylamine 3,4,5-trimethoxybenzoate

Systematic Name

  • Phenethylamine, N-ethyl-N-(4-hydroxybutyl)-2-methoxy-alpha-methyl-, 3,4,5-trimethoxybenzoate

Registry Numbers

CAS Registry Number

  • 67293-28-1

System Generated Number

  • 0067293281

Structure Descriptors

InChI

1S/C26H37NO6/c1-7-27(19(2)16-20-12-8-9-13-22(20)29-3)14-10-11-15-33-26(28)21-17-23(30-4)25(32-6)24(18-21)31-5/h8-9,12-13,17-19H,7,10-11,14-16H2,1-6H3

InChIKey

GBEFJBUJDJXMSH-UHFFFAOYSA-N

Smiles

CCN(CCCCOC(=O)c1cc(c(c(c1)OC)OC)OC)C(C)Cc2ccccc2OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 60mg/kg (60mg/kg)   Journal of Medicinal Chemistry. Vol. 6, Pg. 97, 1963.