Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Oxayohimban-16-carboxylic acid, 16,17-didehydro-19-methyl-, 2-(1-piperidinyl)ethyl ester, dihydrochloride, (19-alpha)-
RN: 56435-58-6
InChIKey: BIZZBRKQBHYYMG-HUYWVPSPSA-N

Molecular Formula

  • C27-H35-N3-O3.2Cl-H

Molecular Weight

  • 522.5133
 
* 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

Synonyms

  • Chlorhydrate de raubasinate de N-beta-ethylpiperidine
  • Chlorhydrate de raubasinate de N-beta-ethylpiperidine [French]
  • N-beta-Ethyl-piperidine raubasinate dihydrochloride

Systematic Name

  • Oxayohimban-16-carboxylic acid, 16,17-didehydro-19-methyl-, 2-(1-piperidinyl)ethyl ester, dihydrochloride, (19-alpha)-

Registry Numbers

CAS Registry Number

  • 56435-58-6

System Generated Number

  • 0056435586

Molecular Formulas

Molecular Formula

  • C27-H35-N3-O3.2Cl-H

Molecular Formula Fragments

  • C27-H35-N3-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C27H35N3O3.2ClH/c1-18-22-16-30-12-9-20-19-7-3-4-8-24(19)28-26(20)25(30)15-21(22)23(17-33-18)27(31)32-14-13-29-10-5-2-6-11-29;;/h3-4,7-8,17-18,21-22,25,28H,2,5-6,9-16H2,1H3;2*1H/t18-,21-,22+,25-;;/m0../s1

InChIKey

BIZZBRKQBHYYMG-HUYWVPSPSA-N

Smiles

C[C@H]1[C@H]2CN3CCc4c5ccccc5[nH]c4[C@@H]3C[C@@H]2C(=CO1)C(=O)OCCN6CCCCC6.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 45mg/kg (45mg/kg)   French Demande Patent Document. Vol. #2343476,
mouse LD50 oral 1650mg/kg (1650mg/kg)   French Demande Patent Document. Vol. #2343476,