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Key Documents

SMB01317

Sigma-Aldrich

Sinapine thiocyanate

Synonym(s):

Sinapine cyanide sulfonate, Sinapine thiocyanate anhydrous

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About This Item

Empirical Formula (Hill Notation):
C17H24N2O5S
CAS Number:
7431-77-8
Molecular Weight:
368.45
UNSPSC Code:
12352205
NACRES:
NA.77

biological source

synthetic

Quality Level

100

grade

research grade

Assay

≥98%

form

powder

storage condition

(keep sealed and from light)

technique(s)

HPLC: suitable

color

light yellow

storage temp.

−20°C

InChI

1S/C16H23NO5.CHNS/c1-17(2,3)8-9-22-16(19)7-6-12-10-15(21-5)13(18)11-14(12)20-4;2-1-3/h6-7,10-11H,8-9H2,1-5H3;3H

InChI key

NPOZDPAVPFLLCN-UHFFFAOYSA-N

General description

Sinapine thiocyanate is a salt of sinapine, the choline ester of sinapic acid. Sinapine is known to be present in some foods such as cauliflower, and it has been studied as a dietary precursor of TMAO (trimethylamine N-oxide) in rapeseed-derived feed for pigs.

Application

Metabolomics research, microbiome research

Other Notes

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Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

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