6'-0-BETA-GLUCOSYLAUCUBIN

Structure

2D structure of 6'-0-BETA-GLUCOSYLAUCUBIN
2D structure
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3D model

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

Names and identifiers

Name

6'-0-BETA-GLUCOSYLAUCUBIN

IUPAC name

(2R,3S,4R,5R,6S)-2-((5-hydroxy-7-(hydroxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl)oxy)-6-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-3,4,5-triol

SMILES

C1=COC(C2C1C(C=C2CO)O)O[C@@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O

General information

Molecular formula

C21H32O14

Molecular weight

508.47 g/mol

Monoisotopic mass

508.1792 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Plantago major L. leaf -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.