| Record Information |
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| Version | 1.0 |
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| Creation date | 2017-01-17 15:20:45 UTC |
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| Update date | 2017-01-17 15:20:45 UTC |
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| FoodComEx ID | PC001042 |
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| FoodDB Record | Not Available |
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| Chemical Information |
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| Name | Quercetin 3-O-glucuronide |
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| Description | Quercetin 3-O-glucuronide is one of the main metabolites of quercetin |
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| CAS Number | Not Available |
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| Structure | |
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| Synonyms | |
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| Chemical Formula | Not Available |
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| IUPAC name | Not Available |
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| InChI Identifier | InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31) |
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| InChI Key | DUBCCGAQYVUYEU-UHFFFAOYSA-N |
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| Isomeric SMILES | OC1C(O)C(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C(O)=C2)OC(C1O)C(O)=O |
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| Average Molecular Weight | 478.3598 |
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| Monoisotopic Molecular Weight | 478.074740662 |
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| Chemical Taxonomy |
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| Class | Flavonoid |
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| Family | flavonols |
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| Physico-Chemical Properties - Experimental |
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| Property | Value | Reference |
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| Experimental logP | Not Available | |
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| Experimental Water Solubility | Not Available | |
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| Melting Point | Not Available | |
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| Foods of Origin |
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| Food | Content Range | Average | Reference |
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| Food | | | Reference |
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| Production Data |
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| Production Method | enzymatic synthesis |
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| Production Method Reference | Dueñas M, Mingo-Chornet H, Pérez-Alonso JJ, Di Paola-Naranjo R, González-Paramás A, Santos-Buelga C. Preparation of quercetin glucuronides and characterization by HPLC–DAD–ESI/MS. European Food Research and Technology. 2008, 227: 1069-1076. |
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| Production Method Reference File | Not Available |
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| Quantity Available | Production upon request, in mg |
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| Delivery Time | Not Available |
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| Storage Form | solid |
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| Storage Conditions | RT |
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| Stability | Not Available |
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| Purity | >90% |
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| Spectra |
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| Spectral Data Upon Request | Not Available |
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| Provider Information |
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| Contact Name | Contact Institution | Contact Email |
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| Celestino Santos-Buelga | Universidad de Salamanca, Area de Nutrición y Bromatología, Facultad de Farmacia - Campus Miguel de Unamuno, Salamanca, ES, 37007 | csb@usal.es |
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