Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1-alpha-H,5-alpha-H-Tropanium, 8-heptyl-3-hydroxy-, bromide, benzilate
RN: 74051-28-8
InChIKey: SEPPJEXTPZYRKN-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H40-N-O3.Br

Molecular Weight

  • 530.543
 
* 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

  • 8-Heptyl-3-hydroxy-1-alpha-H,5-alpha-H-tropanium bromide benzilate

Systematic Name

  • 1-alpha-H,5-alpha-H-Tropanium, 8-heptyl-3-hydroxy-, bromide, benzilate

Registry Numbers

CAS Registry Number

  • 74051-28-8

System Generated Number

  • 0074051288

Molecular Formulas

Molecular Formula

  • C29-H40-N-O3.Br

Molecular Formula Fragments

  • Br
  • C29-H40-N-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C29H40NO3.BrH/c1-3-4-5-6-13-20-30(2)25-18-19-26(30)22-27(21-25)33-28(31)29(32,23-14-9-7-10-15-23)24-16-11-8-12-17-24;/h7-12,14-17,25-27,32H,3-6,13,18-22H2,1-2H3;1H/q+1;/p-1

InChIKey

SEPPJEXTPZYRKN-UHFFFAOYSA-M

Smiles

CCCCCCC[N+]1(C2CCC1CC(C2)OC(=O)C(c3ccccc3)(c4ccccc4)O)C.[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 62mg/kg (62mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 7, Pg. 217, 1957.