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Substance Name: Ethanone, 1-(2,6-bis(2-hydroxy-3-(4-hydroxy-4-phenyl-1-piperidinyl)propoxy)phenyl)-
RN: 87049-29-4
InChIKey: SGINKSRVTMZODA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C36-H46-N2-O7

Molecular Weight

  • 618.766
 
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Names and Synonyms

Synonyms

  • 1-(2,6-Bis(2-hydroxy-3-(4-hydroxy-4-phenyl-1-piperidinyl)propoxy)phenyl)ethanone
  • BRN 4628152

Systematic Name

  • Ethanone, 1-(2,6-bis(2-hydroxy-3-(4-hydroxy-4-phenyl-1-piperidinyl)propoxy)phenyl)-

Registry Numbers

CAS Registry Number

  • 87049-29-4

System Generated Number

  • 0087049294

Structure Descriptors

InChI

1S/C36H46N2O7/c1-27(39)34-32(44-25-30(40)23-37-19-15-35(42,16-20-37)28-9-4-2-5-10-28)13-8-14-33(34)45-26-31(41)24-38-21-17-36(43,18-22-38)29-11-6-3-7-12-29/h2-14,30-31,40-43H,15-26H2,1H3

InChIKey

SGINKSRVTMZODA-UHFFFAOYSA-N

Smiles

c1(c(cccc1OC[C@@H](CN1CCC(c2ccccc2)(O)CC1)O)OC[C@@H](CN1CCC(c2ccccc2)(O)CC1)O)C(C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 215mg/kg (215mg/kg) BEHAVIORAL: EXCITEMENT Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 22, Pg. 140, 1983.