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Substance Name: Skimmianine
RN: 83-95-4
UNII: 4E1KLC380B
InChIKey: SLSIBLKBHNKZTB-UHFFFAOYSA-N

Note

  • Furanoquinoline alkaloid from Teclea (RUTACEAE).

Classification Code

  • Mutation Data

Molecular Formula

  • C14-H13-N-O4

Molecular Weight

  • 259.26
 
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Names and Synonyms

Name of Substance

  • Skimmianine

Synonyms

  • 4-27-00-02296 (Beilstein Handbook Reference)
  • beta-Fagarine
  • BRN 0028904
  • CCRIS 1585
  • Chloroxylonine
  • NSC 217986
  • Skimmiamine
  • Skimmianin
  • Skimmianine
  • UNII-4E1KLC380B

Systematic Names

  • Furo(2,3-b)quinoline, 4,7,8-trimethoxy-
  • Skimmianine

Registry Numbers

CAS Registry Number

  • 83-95-4

FDA UNII

  • 4E1KLC380B

System Generated Number

  • 0000083954

Structure Descriptors

InChI

1S/C14H13NO4/c1-16-10-5-4-8-11(13(10)18-3)15-14-9(6-7-19-14)12(8)17-2/h4-7H,1-3H3

InChIKey

SLSIBLKBHNKZTB-UHFFFAOYSA-N

Smiles

c12c(c(c3ccoc3n2)OC)ccc(c1OC)OC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 177 deg C   EXP
log P (octanol-water) 2.410 (none)   EST
Atmospheric OH Rate Constant 1.79E-10 cm3/molecule-sec 25 EST

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