Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1H-Pyrrolizinium, hexahydro-4-(2-(1,1'-biphenyl)-4-yl-2-oxoethyl)-1-methyl-, bromide, (1S-(1-alpha,7a-beta))-
RN: 66393-10-0
InChIKey: IIYGYAUXNKVHLM-RNIPOHINSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H26-N-O.Br

Molecular Weight

  • 400.3574
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • N-4-Phenylphenacyl ehliotridanium bromide

Systematic Name

  • 1H-Pyrrolizinium, hexahydro-4-(2-(1,1'-biphenyl)-4-yl-2-oxoethyl)-1-methyl-, bromide, (1S-(1-alpha,7a-beta))-

Registry Numbers

CAS Registry Number

  • 66393-10-0

System Generated Number

  • 0066393100

Molecular Formulas

Molecular Formula

  • C22-H26-N-O.Br

Molecular Formula Fragments

  • Br
  • C22-H26-N-O
  • COMPONENT

Structure Descriptors

InChI

1S/C22H26NO.BrH/c1-17-13-15-23(14-5-8-21(17)23)16-22(24)20-11-9-19(10-12-20)18-6-3-2-4-7-18;/h2-4,6-7,9-12,17,21H,5,8,13-16H2,1H3;1H/q+1;/p-1/t17-,21-,23?;/m0./s1

InChIKey

IIYGYAUXNKVHLM-RNIPOHINSA-M

Smiles

C[C@H]1CC[N+]2([C@H]1CCC2)CC(=O)c3ccc(cc3)c4ccccc4.[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 85mg/kg (85mg/kg)   Drugs of the Future. Vol. 5, Pg. 360, 1980.