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Sigma-Aldrich

Thiamine-(4-methyl-13C-thiazol-5-yl-13C3) hydrochloride

99 atom % 13C, 98% (CP)

Synonym(s):

Vitamin B1(4-methyl-13C-thiazol-5-yl-13C3) hydrochloride

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About This Item

Empirical Formula (Hill Notation):
13C4C8H17ClN4OS · HCl
CAS Number:
1257525-77-1
Molecular Weight:
341.24
MDL number:
MFCD17015237
UNSPSC Code:
12352116
PubChem Substance ID:
329764629
NACRES:
NA.24

isotopic purity

99 atom % 13C

Assay

98% (CP)

form

powder

technique(s)

mass spectrometry (MS): suitable

color

white

mp

250 °C (dec) (lit.)

mass shift

M+4

storage temp.

−20°C

SMILES string

Cl.[Cl-].Cc1ncc(C[n+]2[13cH]s[13c](CCO)[13c]2[13CH3])c(N)n1

InChI

1S/C12H17N4OS.2ClH/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13;;/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15);2*1H/q+1;;/p-1/i1+1,7+1,8+1,11+1;;

InChI key

DPJRMOMPQZCRJU-VJFONHOHSA-M

Application

Thiamine-(4-methyl-13C-thiazol-5-yl-13C3) hydrochloride is also known as vitamin B1(4-methyl-13C-thiazol-5-yl-13C3) hydrochloride. It can be used as a stable isotope internal standard for accurate data interpretation in specific biological samples by mass spectrometry (MS).

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H319

Hazard Classifications

Eye Irrit. 2

Storage Class Code

11 - Combustible Solids

WGK

WGK 1

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

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Certificates of Analysis (COA)

Lot/Batch Number
MBBD2249
MBBD1892
MBBD0024
MBBC9265
MBBC8317

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Rohiverth Guarecuco et al.
Science advances, 6(41) (2020-10-11)
Tumor environment influences anticancer therapy response but which extracellular nutrients affect drug sensitivity is largely unknown. Using functional genomics, we determine modifiers of l-asparaginase (ASNase) response and identify thiamine pyrophosphate kinase 1 as a metabolic dependency under ASNase treatment. While

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