VANILLIN

Structure

2D structure of VANILLIN
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 1183

Names and identifiers

Name

VANILLIN

IUPAC name

4-hydroxy-3-methoxybenzaldehyde

SMILES

COC1=C(C=CC(=C1)C=O)O

General information

Molecular formula

C8H8O3

Molecular weight

152.15 g/mol

Monoisotopic mass

152.0473 Da

Classification

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

Plants with the compound

Plant Plant part Amount Reference
Avena barbata Pott ex Link rhizome -
Dynamic root exudate chemistry and microbial substrate preferences drive patterns in rhizosphere microbial community assembly doi:10.1038/s41564-018-0129-3
Elymus repens (L.) Gould subsp. repens rhizome -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Lolium arundinaceum (Schreb.) Darbysh. subsp. arundinaceum leaf -
Tava, A., Berardo, N., Odoardi, M. (1991). Composition of essential oil of tall fescue. Phytochemistry, 30(5), 1455-1458 doi:10.1016/0031-9422(91)84185-u
Mentha spicata L. essential oil -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Mentha spicata L. leaf -
Duke, J. A. Writeups or information summaries on approximately 2,000 economic plants, USDA, ARS, Beltsville, MD 20705.
Rosa canina L. fruit -
List, P.H. and Horhammer, L., Hager's Handbuch der Pharmazeutischen Praxis, Vols. 2-6, Springer-Verlag, Berlin, 1969-1979.
Urtica dioica L. root -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Vaccinium myrtillus L. fruit 0 ppm
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Viola odorata L. flower -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.