GLUCONAPIN

Structure

2D structure of GLUCONAPIN
2D structure
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3D model

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

Names and identifiers

Name

GLUCONAPIN

IUPAC name

((Z)-1-(((2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)thio)pent-4-en-1-ylidene)amino sulfate

SMILES

C=CCCC(=NO[S](=O)(=O)[O-])S[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)CO)O)O)O

General information

Molecular formula

C11H18NO9S2-

Molecular weight

372.40 g/mol

Monoisotopic mass

372.0428 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Arabidopsis thaliana (L.) Heynh. leaf -
Hogge, L.R., Reed, D.W., Underhill, E.W., Haughn, G.W. (1988). Hplc separation of glucosinolates from leaves and seeds of Arabidopsis thaliana and their identification usinig thermospray liquid chromatography/mass spectrometry. J Chromatogr Sci, 26(11), 551-556 doi:10.1093/chromsci/26.11.551
Arabidopsis thaliana (L.) Heynh. seed -
Hogge, L.R., Reed, D.W., Underhill, E.W., Haughn, G.W. (1988). Hplc separation of glucosinolates from leaves and seeds of Arabidopsis thaliana and their identification usinig thermospray liquid chromatography/mass spectrometry. J Chromatogr Sci, 26(11), 551-556 doi:10.1093/chromsci/26.11.551
Capsella bursa-pastoris (L.) Medik. subsp. bursa-pastoris - -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Lepidium draba L. subsp. draba leaf -
Lockwood, G.B., Belkhiri, A. (1991). Glucosinolate spectrum of some Algerian Cruciferae. Plant Syst Evol, 176, 11-20 doi:10.1007/bf00937942
Mutarda arvensis (L.) D.A.German seed -
Bachelard, H.S., Trikojus, V.M. (1963). Studies on endemic goiter. I. the identification and their aglucons in weed contaminants of pastures in goitrous areas of Tasmania and southern Queensland. J Biol Sci, 16, 147-165 doi:10.1071/bi9630147