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Substance Name: Quinidine-N-oxide
RN: 70116-00-6
UNII: T0RV6T22HZ
InChIKey: WVDIZKMXQMCCAA-ROCUERRRSA-N

Note

  • Major metabolite of quinidine.

Molecular Formula

  • C20-H24-N2-O3

Molecular Weight

  • 340.4206
 
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Names and Synonyms

Name of Substance

  • Quinidine-N-oxide

Synonym

  • UNII-T0RV6T22HZ

Systematic Name

  • Cinchonan-9-ol, 6'-methoxy-, 1-oxide, (9S)-

Registry Numbers

CAS Registry Number

  • 70116-00-6

FDA UNII

  • T0RV6T22HZ

System Generated Number

  • 0070116006

Structure Descriptors

InChI

1S/C20H24N2O3/c1-3-13-12-22(24)9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(25-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19+,20-,22+/m0/s1

InChIKey

WVDIZKMXQMCCAA-ROCUERRRSA-N

Smiles

COc1ccc2nccc([C@H](O)[C@H]3C[C@@H]4CC[N@@+]3([O-])C[C@@H]4C=C)c2c1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.530 (none)   EST
Water Solubility 9600 mg/L 20 EXP
Vapor Pressure 4.86E-16 mm Hg 25 EST
Henry's Law Constant 6.88E-23 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.69E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.