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Substance Name: 5-Benzofuranmethanol, 4,7-dimethoxy-alpha-(2-(3-hydroxyphenyl)ethyl)-6- (2-(1-piperidinyl)ethoxy)-
RN: 40681-05-8
InChIKey: HHCOPHHIQMZKMN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H33-N-O6

Molecular Weight

  • 455.548
 
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Names and Synonyms

Synonyms

  • 5-20-02-00137 (Beilstein Handbook Reference)
  • BRN 1276209

Systematic Name

  • 5-Benzofuranmethanol, 4,7-dimethoxy-alpha-(2-(3-hydroxyphenyl)ethyl)-6- (2-(1-piperidinyl)ethoxy)-

Registry Numbers

CAS Registry Number

  • 40681-05-8

System Generated Number

  • 0040681058

Structure Descriptors

InChI

1S/C26H33NO6/c1-30-23-20-11-15-32-24(20)26(31-2)25(33-16-14-27-12-4-3-5-13-27)22(23)21(29)10-9-18-7-6-8-19(28)17-18/h6-8,11,15,17,21,28-29H,3-5,9-10,12-14,16H2,1-2H3

InChIKey

HHCOPHHIQMZKMN-UHFFFAOYSA-N

Smiles

c1(c(c(c2occc2c1OC)OC)OCCN1CCCCC1)[C@@H](CCc1cc(ccc1)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 8mg/kg (8mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 85, 1974.
mouse LD50 oral 550mg/kg (550mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 85, 1974.