6-O-ACETYL-MIOPOROSIDE

Structure

2D structure of 6-O-ACETYL-MIOPOROSIDE
2D structure
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3D model

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

Names and identifiers

Name

6-O-ACETYL-MIOPOROSIDE

IUPAC name

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

SMILES

C1=CO[C@H]([C@H]2[C@@H]1[C@H](C[C@]2(C)O)CC(C)=C)O[C@H]3[C@@H]([C@H]([C@@H]([C@@H](CO)O3)O)O)O

General information

Molecular formula

C19H30O8

Molecular weight

386.44 g/mol

Monoisotopic mass

386.1941 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Betonica officinalis L. aerial parts 27 ppm
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.