MACFADIENOSIDE

Structure

2D structure of MACFADIENOSIDE
2D structure
Drag to rotate, scroll to zoom
3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 13892726

Names and identifiers

Name

MACFADIENOSIDE

IUPAC name

(2S,3R,4S,5S,6R)-2-(((1aS,1bS,2S,5aS,6R,6aS)-5a,6-dihydroxy-1a-(hydroxymethyl)-1a,1b,2,5a,6,6a-hexahydrooxireno[2',3':4,5]cyclopenta[1,2-c]pyran-2-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol

SMILES

C1=CO[C@H]([C@H]2[C@@]1([C@@H]([C@H]3[C@@]2(O3)CO)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O

General information

Molecular formula

C15H22O11

Molecular weight

378.33 g/mol

Monoisotopic mass

378.1162 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Cymbalaria muralis G.Gaertn., B.Mey. & Scherb. subsp. muralis - -
Bianco, A., Guiso, M., Pellegrini, G., Nicoletti, M., Serafini, M. (1997). Muralioside, an iridoid from Cymbalaria muralis. Phytochemistry, 44(8), 1515-1517 doi:10.1016/s0031-9422(96)00717-0