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Merck
CN

91890

Trigonelline hydrochloride

≥98.0% (AT)

Synonym(s):

1-Methylpyridinium-3-carboxylate hydrochloride, N-Methylnicotinic acid betaine hydrochloride

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About This Item

Empirical Formula (Hill Notation):
C7H7NO2 · HCl
CAS Number:
6138-41-6
Molecular Weight:
173.60
UNSPSC Code:
12352200
PubChem Substance ID:
329770093
EC Number:
228-119-5
Beilstein/REAXYS Number:
3734169
MDL number:
MFCD00077250

Key Documents

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SMILES string

[Na+].[Na+].[Na+].[Na+].Oc1c(\N=N\c2ccc(cc2S([O-])(=O)=O)\N=N\c3ccc(cc3)S([O-])(=O)=O)c4ccc(cc4cc1S([O-])(=O)=O)S([O-])(=O)=O, [Cl-].C[n+]1cccc(c1)C(O)=O

InChI key

TZSYLWAXZMNUJB-UHFFFAOYSA-N

InChI

1S/C7H7NO2.ClH/c1-8-4-2-3-6(5-8)7(9)10;/h2-5H,1H3;1H

assay

≥98.0% (AT)

form

powder or crystals

mp

~260 °C (dec.)

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Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
BCBZ3286
BCBV0631
BCBS1531V
BCBQ3758V

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J Zhou et al.
Current medicinal chemistry, 19(21), 3523-3531 (2012-06-12)
There is evidence that Trigonella foenum-graecum L. (fenugreek), a traditional Chinese herb, and its components are beneficial in the prevention and treatment of diabetes and central nervous system disease. The pharmacological activities of trigonelline, a major alkaloid component of fenugreek
Laura Sánchez-Hernández et al.
Electrophoresis, 32(11), 1394-1401 (2011-04-27)
A CE-tandem mass spectrometry (MS²) methodology enabling the simultaneous determination of betaines (glycine betaine, trigonelline, proline betaine and total content of carnitines) in vegetable oils was developed. Betaines were derivatized with butanol previous to their baseline separation in 10 min using
Laura Sánchez-Hernández et al.
Journal of agricultural and food chemistry, 58(13), 7489-7496 (2010-06-17)
A capillary electrophoresis method with UV detection was developed for the first time for the determination of the pyridine betaine trigonelline (N-methylnicotinic acid) in seeds and vegetable oils. Analytical characteristics of the method showed its good performance in terms of
Arvindkumar E Ghule et al.
International immunopharmacology, 14(4), 740-748 (2012-10-30)
Oxidative stress and apoptotic cell death in kidney have been suggested as contributing factors in the development and complication of diabetes especially in diabetic nephropathy (DN). This study investigated the effects of trigonelline (TG) on the renal functional, morphological changes
A Arlt et al.
Oncogene, 32(40), 4825-4835 (2012-10-31)
Evidence accumulates that the transcription factor nuclear factor E2-related factor 2 (Nrf2) has an essential role in cancer development and chemoresistance, thus pointing to its potential as an anticancer target and undermining its suitability in chemoprevention. Through the induction of
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