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Substance Name: Esculamine hydrochloride
RN: 1039-82-3
InChIKey: ROUMMYJFCVVORX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H19-N-O6.Cl-H

Molecular Weight

  • 345.777
 
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Names and Synonyms

Results Name

  • Esculamine hydrochloride

Synonyms

  • 8-beta,beta'-Dioxydiethylaminomethyl-4-methylesculatin hydrochloride
  • Esculamine hydrochloride

Systematic Name

  • Coumarin, 8-((bis(2-hydroxyethyl)amino)methyl)-6,7-dihydroxy-4-methyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 1039-82-3

Related Registry Number

  • 2908-75-0 (Parent)

System Generated Number

  • 0001039823

Molecular Formulas

Molecular Formula

  • C15-H19-N-O6.Cl-H

Molecular Formula Fragments

  • C15-H19-N-O6
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H19NO6.ClH/c1-9-6-13(20)22-15-10(9)7-12(19)14(21)11(15)8-16(2-4-17)3-5-18;/h6-7,17-19,21H,2-5,8H2,1H3;1H

InChIKey

ROUMMYJFCVVORX-UHFFFAOYSA-N

Smiles

c12c(C[NH+](CCO)CCO)c(c(O)cc1c(cc(o2)=O)C)O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 2275mg/kg (2275mg/kg) BEHAVIORAL: TREMOR

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)

BEHAVIORAL: MUSCLE WEAKNESS
Farmakologiya i Toksikologiya Vol. 28, Pg. 314, 1965.