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Substance Name: Allixin
RN: 125263-70-9
UNII: 851A356OPF
InChIKey: OHRPDNHRQKOLGN-UHFFFAOYSA-N

Note

  • Phytoalexin produced by garlic.

Molecular Formula

  • C12-H18-O4

Molecular Weight

  • 226.2702
 
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Names and Synonyms

Name of Substance

  • Allixin

Synonyms

  • 3-Hydroxy-5-methoxy-6-methyl-2-pentyl-4H-pyran-4-one
  • Allixin
  • UNII-851A356OPF

Systematic Name

  • 4H-Pyran-4-one, 3-hydroxy-5-methoxy-6-methyl-2-pentyl-

Registry Numbers

CAS Registry Number

  • 125263-70-9

FDA UNII

  • 851A356OPF

System Generated Number

  • 0125263709

Structure Descriptors

InChI

1S/C12H18O4/c1-4-5-6-7-9-10(13)11(14)12(15-3)8(2)16-9/h13H,4-7H2,1-3H3

InChIKey

OHRPDNHRQKOLGN-UHFFFAOYSA-N

Smiles

CCCCCc1c(c(=O)c(c(o1)C)OC)O