Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 4-Quinolinol, decahydro-1,2-dimethyl-4-ethenyl-, benzoate (ester), hydrochloride, (2-alpha,4-alpha,4a-alpha,8a-beta)-
RN: 110345-60-3
InChIKey: PXCBCNQBYIAUHB-MTNAZVQPSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H27-N-O2.Cl-H

Molecular Weight

  • 349.8992
 
* 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

  • 4-Quinolinol, decahydro-1,2-dimethyl-4-ethenyl-, benzoate (ester), hydrochloride, (2-alpha,4-alpha,4a-alpha,8a-beta)-

Registry Numbers

CAS Registry Number

  • 110345-60-3

System Generated Number

  • 0110345603

Molecular Formulas

Molecular Formula

  • C20-H27-N-O2.Cl-H

Molecular Formula Fragments

  • C20-H27-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H27NO2.ClH/c1-4-20(23-19(22)16-10-6-5-7-11-16)14-15(2)21(3)18-13-9-8-12-17(18)20;/h4-7,10-11,15,17-18H,1,8-9,12-14H2,2-3H3;1H/t15-,17+,18+,20+;/m1./s1

InChIKey

PXCBCNQBYIAUHB-MTNAZVQPSA-N

Smiles

C[C@@H]1C[C@]([C@H]2CCCC[C@@H]2N1C)(C=C)OC(=O)c3ccccc3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 183mg/kg (183mg/kg)   Pharmaceutical Chemistry Journal Vol. 21, Pg. 247, 1987.
mouse LD50 subcutaneous 317mg/kg (317mg/kg)   Pharmaceutical Chemistry Journal Vol. 21, Pg. 247, 1987.