CYCLOHEX-2-EN-1-ONE,2-4-4-TRIMETHYL-3-(BETA-D-GLUCOPYRANOSYL-OXY-METHYL)

Structure

2D structure of CYCLOHEX-2-EN-1-ONE,2-4-4-TRIMETHYL-3-(BETA-D-GLUCOPYRANOSYL-OXY-METHYL)
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 21631030

Names and identifiers

Name

CYCLOHEX-2-EN-1-ONE,2-4-4-TRIMETHYL-3-(BETA-D-GLUCOPYRANOSYL-OXY-METHYL)

IUPAC name

2,4,4-trimethyl-3-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)cyclohex-2-en-1-one

SMILES

C1(C(=C(C(CC1)(C)C)CO[C@H]2[C@@H]([C@H]([C@@H]([C@@H](CO)O2)O)O)O)C)=O

General information

Molecular formula

C16H26O7

Molecular weight

330.38 g/mol

Monoisotopic mass

330.1679 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Eryngium campestre L. root -
Erdelmeier, C.A.J., Sticher, O. (1986). A cyclohexenone and a cyclohexadienone glycoside from Eryngium campestre. Phytochemistry, 25(3), 741-743 doi:10.1016/0031-9422(86)88036-0