GLUCOSINOLATE,1-METHOXY-3-INDOLYL-METHYL:

Structure

2D structure of GLUCOSINOLATE,1-METHOXY-3-INDOLYL-METHYL:
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 9576416

Names and identifiers

Name

GLUCOSINOLATE,1-METHOXY-3-INDOLYL-METHYL:

IUPAC name

((((Z)-2-(1-methoxy-1H-indol-3-yl)-1-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)thio)ethylidene)amino)oxy)sulfonic acid

SMILES

CON1C=C(C2=CC=CC=C21)C/C(=N/OS(=O)(=O)O)/S[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O

General information

Molecular formula

C17H22N2O10S2

Molecular weight

478.50 g/mol

Monoisotopic mass

478.0716 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
Diplotaxis erucoides (L.) DC. subsp. erucoides root -
Lockwood, G.B., Belkhiri, A. (1991). Glucosinolate spectrum of some Algerian Cruciferae. Plant Syst Evol, 176, 11-20 doi:10.1007/bf00937942