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Substance Name: Benzenepropanol, alpha-(3,6-dimethoxy-2-(2-(1-piperidinyl)ethoxy)phenyl)-2-hydroxy-, hydrochloride, hydrate
RN: 88770-60-9
InChIKey: DGXBMSJIKZAJRT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H33-N-O5.Cl-H.H2-O

Molecular Weight

  • 470.0024
 
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Names and Synonyms

  • Benzenepropanol, alpha-(3,6-dimethoxy-2-(2-(1-piperidinyl)ethoxy)phenyl)-2-hydroxy-, hydrochloride, hydrate

Registry Numbers

CAS Registry Number

  • 88770-60-9

System Generated Number

  • 0088770609

Molecular Formulas

Molecular Formula

  • C24-H33-N-O5.Cl-H.H2-O

Molecular Formula Fragments

  • C24-H33-N-O5
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C24H33NO5.ClH.H2O/c1-28-21-12-13-22(29-2)24(30-17-16-25-14-6-3-7-15-25)23(21)20(27)11-10-18-8-4-5-9-19(18)26;;/h4-5,8-9,12-13,20,26-27H,3,6-7,10-11,14-17H2,1-2H3;1H;1H2

InChIKey

DGXBMSJIKZAJRT-UHFFFAOYSA-N

Smiles

c1(c(c(ccc1OC)OC)OCCN1CCCCC1)C(CCc1c(O)cccc1)O.Cl.O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 12mg/kg (12mg/kg)   United States Patent Document. Vol. #4732896,