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Substance Name: 5-Benzofuranmethanol, 4,7-dimethoxy-alpha-(2-(2-hydroxyphenyl)ethyl)-6- (2-(1-pyrrolidinyl)ethoxy)-
RN: 40680-98-6
InChIKey: QZBMAYYUOUFMSV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H31-N-O6

Molecular Weight

  • 441.521
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 40680-98-6

System Generated Number

  • 0040680986

Structure Descriptors

InChI

1S/C25H31NO6/c1-29-22-18-11-15-31-23(18)25(30-2)24(32-16-14-26-12-5-6-13-26)21(22)20(28)10-9-17-7-3-4-8-19(17)27/h3-4,7-8,11,15,20,27-28H,5-6,9-10,12-14,16H2,1-2H3

InChIKey

QZBMAYYUOUFMSV-UHFFFAOYSA-N

Smiles

c1(c(c(c2ccoc2c1OC)OC)[C@@H](CCc1c(cccc1)O)O)OCCN1CCCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 9500ug/kg (9.5mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 85, 1974.
mouse LD50 oral 475mg/kg (475mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 85, 1974.