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Substance Name: Shogaol
RN: 555-66-8
InChIKey: OQWKEEOHDMUXEO-BQYQJAHWSA-N

Note

  • From ginger, Zingiber officinale; less mutagenic than gingerol.

Classification Codes

  • Mutagens
  • Mutation Data
  • Noxae

Molecular Formula

  • C17-H24-O3

Molecular Weight

  • 276.374
 
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Names and Synonyms

Name of Substance

  • Shogaol

Synonyms

  • (6)-Shogaol
  • CCRIS 2038
  • Shogaol

Systematic Names

  • 4-Decen-3-one, 1-(4-hydroxy-3-methoxyphenyl)-
  • Shogaol

Registry Numbers

CAS Registry Number

  • 555-66-8

System Generated Number

  • 0000555668

Structure Descriptors

InChI

1S/C17H24O3/c1-3-4-5-6-7-8-15(18)11-9-14-10-12-16(19)17(13-14)20-2/h7-8,10,12-13,19H,3-6,9,11H2,1-2H3/b8-7+

InChIKey

OQWKEEOHDMUXEO-BQYQJAHWSA-N

Smiles

c1(cc(c(O)cc1)OC)CCC(\C=C\CCCCC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 109mg/kg (109mg/kg)   Journal of Pharmacobio-Dynamics. Vol. 7, Pg. 836, 1984.
mouse LD50 intravenous 50900ug/kg (50.9mg/kg)   Journal of Pharmacobio-Dynamics. Vol. 7, Pg. 836, 1984.
mouse LD50 oral 687mg/kg (687mg/kg)   Journal of Pharmacobio-Dynamics. Vol. 7, Pg. 836, 1984.