TRIGONELLINE

Structure

2D structure of TRIGONELLINE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 5570

Names and identifiers

Name

TRIGONELLINE

IUPAC name

1-methylpyridin-1-ium-3-carboxylate

SMILES

C[N+]1=CC=CC(=C1)C(=O)[O-]

General information

Molecular formula

C7H7NO2

Molecular weight

137.14 g/mol

Monoisotopic mass

137.0477 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Achillea millefolium L. subsp. millefolium - -
Tunon, H., Thorsell, W., and Bohlin, L. 1993. Mosquito Repelling Activity of Compounds Occurring in Achillea millefolium L. (Asteraceae). Economic Botany 48(2): 111-120, 1994.
Chenopodium album L. subsp. album - -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Medicago sativa L. - -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Medicago sativa L. seed -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Morus alba L. leaf -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Sorghum halepense (L.) Pers. seed -
Evans, L.S., Tramontano, W.A. (1984). Trigonelline and promotion of cell arrest in g2 of various legumes. Phytochemistry, 23(9), 1837-1840 doi:10.1016/s0031-9422(00)84927-4
Triticum aestivum L. subsp. aestivum seed -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.