Chemical fact sheet: Quercetin 3-O-glucuronide

The BCDB-database is not an authoritative database. This sheet collates data stored for chemical entry quercetin 3-O-glucuronide and its related chemical compound entries miquelianin .

Quercetin 3-O-glucuronide

Basics

Category
Flavone and flavonol derivatives
IUPAC-name
(2S,3S,4S,5R)-6-((2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
Formula
C21H18O13
Exact mass
478.07474 g/mol
Molecular weight
478.40000 g/mol
Structure
Chemical structure of quercetin 3-O-glucuronide
Figure 1.1: Chemical structure of quercetin 3-O-glucuronide

Sources

In summary, the chemical quercetin 3-O-glucuronide has been analyzed from following sources:

Polygonum tinctorium
1st
Tanacetum vulgare  L.
1st 2nd 3rd

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

References

  1. E. Tatsis, S. Boeren, V. Exarchou, A. Troganis, J. Vervoort, and I. Gerothanassis, "Identification of the major constituents of Hypericum perforatum by LC/SPE/NMR and/or LC/MS.," Phytochemistry , vol. 68 , no. 3 , pp. 383–393 , DOI: 10.1016/j.phytochem.2006.11.026 .
  2. N. Devrnja, B. Anđelković, S. Aranđelović, S. Radulović, M. Soković, D. Krstić-Milošević, M. Ristić, and D. Ćalić, "Comparative studies on the antimicrobial and cytotoxic activities of Tanacetum vulgare L. essentiall oils and methanol extracts.," South African Journal of Botany , vol. 111 , pp. 212–221 , DOI: 10.1016/j.sajb.2017.03.028 .
  3. H. Kimura, T. Ishihara, M. Michida, S. Ogawa, T. Akihiro, and K. Yokota, "Identification and quantitative analysis of polyphenolic compounds from the indigo plant (Polygonum tinctorium Lour).," Natural Product Research , vol. 28 , no. 7 , pp. 492–495 , DOI: 10.1080/14786419.2013.871719 .

Analysis results

Analysis result 1

Detection technique Values Units
UV/Vis 254
370 		nm
[M⁻ H]⁻ 477.06680 m/z
STD
False
TLC
False
UV/Vis detector description
LC-diode array (DAD)
Mass spectrometer description
ESI-TOF-MS
Organism
Tanacetum vulgare  L.
wild
dried, powdered
Collection dates
2012
Sample note
The plant was authenticated by the authors; rev.: Dr. Goran Anackov and prepared as herbarium specimens and were deposited at the Herbarium of the Department of Biology and Ecology-BUNS Herbariumm University of Novi Sad, voucher No. 2-2069.
Drying methods
air-dried
Dried material storage temperature
15 °C
Dried material storage notes
dark; as whole
Extraction solvents
methanol
Extraction mass/volume-ratio
100 mg/mL
Extraction repeats
1
Extraction time
2 d 20 min
Extraction temperature
20±5 °C
Extract drying method
evaporation under vacuum
Extract drying temperature
40 °C
Dried extract storage temperature
20±5 °C
Analysis solvents
MeOH
Detection note
Other, less abundant m/z values: 478.0704, 513.0459, 523.0718
References

N. Devrnja, B. Anđelković, S. Aranđelović, S. Radulović, M. Soković, D. Krstić-Milošević, M. Ristić, and D. Ćalić, "Comparative studies on the antimicrobial and cytotoxic activities of Tanacetum vulgare L. essentiall oils and methanol extracts.," South African Journal of Botany , vol. 111 , pp. 212–221 , DOI: 10.1016/j.sajb.2017.03.028 .

Analysis result 2

Detection technique Values Units
UV/Vis 254
370 		nm
[M⁻ H]⁻ 477.06680 m/z
STD
False
TLC
False
UV/Vis detector description
LC-diode array (DAD)
Mass spectrometer description
ESI-TOF-MS
Organism
Tanacetum vulgare  L.
wild
dried, powdered
Collection dates
2012
Sample note
The plant was authenticated by the authors; rev.: Dr. Goran Anackov and prepared as herbarium specimens and were deposited at the Herbarium of the Department of Biology and Ecology-BUNS Herbariumm University of Novi Sad, voucher No. 2-2069.
Drying methods
air-dried
Dried material storage temperature
15 °C
Dried material storage notes
dark; as whole
Extraction solvents
methanol
Extraction mass/volume-ratio
100 mg/mL
Extraction repeats
1
Extraction time
2 d 20 min
Extraction temperature
20±5 °C
Extract drying method
evaporation under vacuum
Extract drying temperature
40 °C
Dried extract storage temperature
20±5 °C
Analysis solvents
MeOH
Detection note
Other, less abundant m/z values: 478.0704, 513.0459, 523.0718
References

N. Devrnja, B. Anđelković, S. Aranđelović, S. Radulović, M. Soković, D. Krstić-Milošević, M. Ristić, and D. Ćalić, "Comparative studies on the antimicrobial and cytotoxic activities of Tanacetum vulgare L. essentiall oils and methanol extracts.," South African Journal of Botany , vol. 111 , pp. 212–221 , DOI: 10.1016/j.sajb.2017.03.028 .

Analysis result 3

Detection technique Values Units
UV/Vis 254
370 		nm
[M⁻ H]⁻ 477.06680 m/z
STD
False
TLC
False
UV/Vis detector description
LC-diode array (DAD)
Mass spectrometer description
ESI-TOF-MS
Organism
Tanacetum vulgare  L.
wild
dried, powdered
Collection dates
2012
Sample note
The plant was authenticated by the authors; rev.: Dr. Goran Anackov and prepared as herbarium specimens and were deposited at the Herbarium of the Department of Biology and Ecology-BUNS Herbariumm University of Novi Sad, voucher No. 2-2069.
Drying methods
air-dried
Dried material storage temperature
15 °C
Dried material storage notes
dark; as whole
Extraction solvents
methanol
Extraction mass/volume-ratio
100 mg/mL
Extraction repeats
1
Extraction time
2 d 20 min
Extraction temperature
20±5 °C
Extract drying method
evaporation under vacuum
Extract drying temperature
40 °C
Dried extract storage temperature
20±5 °C
Analysis solvents
MeOH
Detection note
Other, less abundant m/z values: 478.0704, 513.0459, 523.0718
References

N. Devrnja, B. Anđelković, S. Aranđelović, S. Radulović, M. Soković, D. Krstić-Milošević, M. Ristić, and D. Ćalić, "Comparative studies on the antimicrobial and cytotoxic activities of Tanacetum vulgare L. essentiall oils and methanol extracts.," South African Journal of Botany , vol. 111 , pp. 212–221 , DOI: 10.1016/j.sajb.2017.03.028 .

Analysis result 4

Detection technique Values Units
[M⁻ H]⁻ 477.10000 m/z
MS²⁻ 301 m/z
STD
True
TLC
False
UV/Vis detector description
photodiode array (PDA)
Mass spectrometer description
UPLC-ESI/MS
Organism
Polygonum tinctorium
cultivated
ground into 5-mm pieces, fresh, ground
Collection dates
2012
Sample note
The species was confirmed by Professor Shuji Hamasaki et Shimane Prefectual College for Agriculture and Forestry (Ohda, Shimane, Japan). The voucher specimen (voucher number 12001) were deposited in the laboratory of the Department of Research and Development, Kotobuki Seika, Japan).
Extraction solvents
methanol
Extraction mass/volume-ratio
333.3 mg/mL
Extraction repeats
1
Extraction time
3 h
Extraction temperature
20±5 °C
Extract drying method
evaporation to dryness by a rotatory evaporator
Extract drying temperature
40 °C
Analysis solvents
50 % MeOH, 100 % MeOH
Detection note
477.1 --> 301.0 [M – glucuronic acid]–
References

H. Kimura, T. Ishihara, M. Michida, S. Ogawa, T. Akihiro, and K. Yokota, "Identification and quantitative analysis of polyphenolic compounds from the indigo plant (Polygonum tinctorium Lour).," Natural Product Research , vol. 28 , no. 7 , pp. 492–495 , DOI: 10.1080/14786419.2013.871719 .

Miquelianin

Basics

Category
Flavonol
IUPAC-name
(2S,3S,4S,5R,6S)-6-((2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
Formula
C21H18O13
Exact mass
478.07474 g/mol
Molecular weight
No weights stored
Structure
Chemical structure of miquelianin
Figure 2.1: Chemical structure of miquelianin

Sources

No links to any potential source for this chemical in the database.

References

  1. E. Tatsis, S. Boeren, V. Exarchou, A. Troganis, J. Vervoort, and I. Gerothanassis, "Identification of the major constituents of Hypericum perforatum by LC/SPE/NMR and/or LC/MS.," Phytochemistry , vol. 68 , no. 3 , pp. 383–393 , DOI: 10.1016/j.phytochem.2006.11.026 .

Analysis results

No analysis results for this entry in the database.