Chemical fact sheet: Pelargonidin 3-O-glucoside

Pelargonidin 3-O-glucoside

Basics

Category
Anthocyanidin derivatives
IUPAC-name
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-(((3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)chromenylium
Formula
No formula stored
Exact mass
433.11292 g/mol
Molecular weight
No weights stored
Structure
Chemical structure of pelargonidin 3-O-glucoside
Figure 1.1: Chemical structure of pelargonidin 3-O-glucoside

Sources

In summary, the chemical pelargonidin 3-O-glucoside has been analyzed from following sources:

Punica granatum
1st
Ribes nigrum 'Titania'
1st
Ruscus aculeatus  L.
1st

Note that an analysis result in the database may indicate either presence or lack thereof of a chemical in an analyzed sample.

References

  1. V. Di Stefano, R. Pitonzo, M. Novara, D. Bongiorno, S. Indelicato, C. Gentile, G. Avellone, R. Bognanni, S. Scandurra, and M. Melilli, "Antioxidant activity and phenolic composition in pomegranate (Punica granatum L.) genotypes from south Italy by UHPLC-Orbitrap-MS approach.," Journal of the Science of Food and Agriculture , vol. 99 , pp. 1038–1045 , DOI: 10.1002/jsfa.9270 .
  2. L. Longo, and G. Vasapollo, "Determination of anthocyanins in Ruscus aculeatus L. berries.," Journal of Agricultural and Food Chemistry , vol. 53 , no. 2 , pp. 475–479 , DOI: 10.1021/jf0487250 .
  3. R. Slimestad, and H. Solheim, "Anthocyanins from black currants (Ribes nigrum L.).," Journal of Agricultural and Food Chemistry , vol. 50 , pp. 3228–3231 , DOI: 10.1021/jf011581u .

Analysis results

Analysis result 1

Detection technique Values Units
M⁺ 433.11210 m/z
MS²⁺ 271.05930 m/z
STD
False
TLC
False
UV/Vis detector description
UHPLC-DAD
Mass spectrometer description
ESI-MS, quadrupole Orbitrap MS
Organism
Punica granatum
cultivated
squeezed, fresh, frozen, juice
Sample note
The samples were identified and collected by the researchers.
Dried material storage temperature
-20 °C
Dried material storage notes
dark
Extract liquid storage temperature
-20 °C
References

V. Di Stefano, R. Pitonzo, M. Novara, D. Bongiorno, S. Indelicato, C. Gentile, G. Avellone, R. Bognanni, S. Scandurra, and M. Melilli, "Antioxidant activity and phenolic composition in pomegranate (Punica granatum L.) genotypes from south Italy by UHPLC-Orbitrap-MS approach.," Journal of the Science of Food and Agriculture , vol. 99 , pp. 1038–1045 , DOI: 10.1002/jsfa.9270 .

Analysis result 2

Detection technique Values Units
UV/Vis 502 nm
M⁺ 433 m/z
MS²⁺ 271 m/z
STD
False
TLC
False
UV/Vis detector description
Mass spectrometer description
HPLC-DAD-ESI-MS/MS
Organism
Ruscus aculeatus  L.
wild
frozen
Collection dates
2003-12
Sample note
The berries were hand-harvested in the woods of parco Regionale Bosco e Paludi di Rauccio, Lecce, Italy, and placed in polyethylene bags. The plant was classified at the Systematic Botanic and Vegetable Ecology Laboratory of the Department of Biological and Environmental Science and Technology, University of Lecce, as Ruscus aculeatus L.
Dried material storage temperature
-20 °C
Extraction solvents
0.1 % HCl (v/v) in MeOH
Extraction repeats
1
Extraction time
20 h
Extraction temperature
20±5 °C
Extract drying method
evaporation under reduced pressure
Extract drying temperature
30 °C
Analysis solvents
0.01 % HCl aqueous
References

L. Longo, and G. Vasapollo, "Determination of anthocyanins in Ruscus aculeatus L. berries.," Journal of Agricultural and Food Chemistry , vol. 53 , no. 2 , pp. 475–479 , DOI: 10.1021/jf0487250 .

Analysis result 3

Detection technique Values Units
UV/Vis 283
507 		nm
M⁺ 433 m/z
MS²⁺ 271 m/z
STD
False
TLC
False
UV/Vis detector description
HPLC-UV/Vis, photodiode array, HPLC-PAD
Mass spectrometer description
ESI-MS
Organism
Ribes nigrum 'Titania'
cultivated
frozen
Collection dates
2001-8
Sample note
The researchers collected black currant berries (Ribes nigrum, cv. Titania) and voucher specimens are deposited at Polyphenols Laboratories.
Dried material storage temperature
-10 °C
Extraction solvents
methanol, water, trifluoroacetic acid
Extraction mass/volume-ratio
250 mg/mL
Extraction repeats
2
Extraction time
2 d
Extract drying method
evaporation
Analysis solvents
methanol; water
References

R. Slimestad, and H. Solheim, "Anthocyanins from black currants (Ribes nigrum L.).," Journal of Agricultural and Food Chemistry , vol. 50 , pp. 3228–3231 , DOI: 10.1021/jf011581u .