ChemicalBook--->CAS DataBase List--->97465-69-5

97465-69-5

97465-69-5 Structure

97465-69-5 Structure
IdentificationBack Directory
[Name]

Hydroxy-β-sanshool
[CAS]

97465-69-5
[Synonyms]

Hydroxy-β-sanshool
Hydroxy-beta-Sanshool
2,6,8,10-Dodecatetraenamide, N-(2-hydroxy-2-methylpropyl)-, (2E,6E,8E,10E)-
[Molecular Formula]

C16H25NO2
[MDL Number]

MFCD32197380
[MOL File]

97465-69-5.mol
[Molecular Weight]

263.38
Chemical PropertiesBack Directory
[Boiling point ]

471.5±45.0 °C(Predicted)
[density ]

0.973±0.06 g/cm3(Predicted)
[form ]

Solid
[pka]

14.59±0.29(Predicted)
[color ]

White to yellow
[InChI]

InChI=1S/C16H25NO2/c1-4-5-6-7-8-9-10-11-12-13-15(18)17-14-16(2,3)19/h4-9,12-13,19H,10-11,14H2,1-3H3,(H,17,18)/b5-4+,7-6+,9-8+,13-12+
[InChIKey]

LHFKHAVGGJJQFF-UMYNZBAMSA-N
[SMILES]

C(NCC(O)(C)C)(=O)/C=C/CC/C=C/C=C/C=C/C
Hazard InformationBack Directory
[Uses]

Hydroxy-β-sanshool is an alkylamide exists in Zanthoxylum bungeanum oil and Zanthoxylum schinifolium oil[1].
[References]

[1] Zhao ZF, et al. Characterization and comparison of the pungent components in commercial Zanthoxylum bungeanum oil and Zanthoxylum schinifolium oil. J Food Sci. 2013 Oct;78(10):C1516-C1522. DOI:10.1111/1750-3841.12236
[2] Zhang LL, et al. The relationship between alkylamide compound content and pungency intensity of Zanthoxylum bungeanum based on sensory evaluation and ultra-performance liquid chromatography-mass spectrometry/ mass spectrometry (UPLC-MS/MS) analysis. J Sci Food Agric. 2019 Mar 15;99(4):1475-1483. DOI:10.1002/jsfa.9319
[3] Bader M, et al. Dynamic Proteome Alteration and Functional Modulation of Human Saliva Induced by Dietary Chemosensory Stimuli. J Agric Food Chem. 2018 Jun 6;66(22):5621-5634. DOI:10.1021/acs.jafc.8b02092
Spectrum DetailBack Directory
[Spectrum Detail]

Hydroxy-β-sanshool(97465-69-5)1HNMR
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