| Record Information |
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| Version | 1.0 |
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| Creation date | 2017-01-17 12:57:17 UTC |
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| Update date | 2017-01-17 12:57:17 UTC |
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| FoodComEx ID | PC001026 |
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| FoodDB Record | Not Available |
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| Chemical Information |
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| Name | 3'-O-beta-D-Glucuronyl-hesperetin |
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| Description | One of the main circulating metabolites of hesperetin and its dietary derivatives
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| CAS Number | Not Available |
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| Structure | |
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| Synonyms | | Synonym | Source |
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| hesperetin 3'-O-beta-D-glucuronide | FoodComEx |
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| Chemical Formula | Not Available |
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| IUPAC name | Not Available |
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| InChI Identifier | InChI=1S/C22H22O12/c1-31-12-3-2-8(13-7-11(25)16-10(24)5-9(23)6-15(16)32-13)4-14(12)33-22-19(28)17(26)18(27)20(34-22)21(29)30/h2-6,13,17-20,22-24,26-28H,7H2,1H3,(H,29,30)/t13?,17?,18-,19+,20?,22+/m0/s1 |
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| InChI Key | PJAUEKWZQWLQSU-AIUYEONLSA-N |
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| Isomeric SMILES | COC1=CC=C(C=C1O[C@@H]1OC([C@@H](O)C(O)[C@H]1O)C(O)=O)C1CC(=O)C2=C(O1)C=C(O)C=C2O |
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| Average Molecular Weight | 478.406 |
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| Monoisotopic Molecular Weight | 478.111126148 |
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| Chemical Taxonomy |
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| Class | Flavanone |
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| Family | Not Available |
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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 | chemical synthesis |
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| Production Method Reference | M. K. Khan, N. Rakotomanomana, M. Loonis, O. Dangles, J. Agric. Food Chem. 2010, 58, 8437–8443. |
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| Production Method Reference File | Not Available |
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| Quantity Available | Production upon request, in g |
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| Delivery Time | Not Available |
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| Storage Form | powder |
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| Storage Conditions | -18°C |
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| Stability | High |
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| Purity | >90% |
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| Spectra |
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| Spectral Data Upon Request | 1H NMR, 13C NMR, UV |
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| Provider Information |
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| Contact Name | Contact Institution | Contact Email |
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| Olivier Dangles | University of Avignon, Sécurité et Qualité des Produits d'Origine Végétale, Campus JH Fabre 301 rue Baruch de Spinoza, BP 21239, Cedex 9,, Avignon , FR, 84916 | olivier.dangles@univ-avignon.fr |
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