| Record Information |
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| Version | 1.0 |
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| Creation date | 2018-04-16 08:18:42 UTC |
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| Update date | 2018-04-27 10:12:11 UTC |
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| FoodComEx ID | PC001111 |
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| FoodDB Record | FDB029811 |
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| Chemical Information |
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| Name | 3'-Hydroxydaidzein |
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| Description | Metabolite of the soy isoflavone daidzein |
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| CAS Number | 485-63-2 |
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| Structure | |
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| Synonyms | | Synonym | Source |
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| 3-(3,4-Dihydroxyphenyl)-7-hydroxy-4H-1-benzopyran-4-one | ChEBI | | 3',4',7-Trihydroxyisoflavone | ChEBI |
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| Chemical Formula | C15H10O5 |
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| IUPAC name | 3-(3,4-dihydroxyphenyl)-7-hydroxy-4H-chromen-4-one |
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| InChI Identifier | InChI=1S/C15H10O5/c16-9-2-3-10-14(6-9)20-7-11(15(10)19)8-1-4-12(17)13(18)5-8/h1-7,16-18H |
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| InChI Key | DDKGKOOLFLYZDL-UHFFFAOYSA-N |
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| Isomeric SMILES | OC1=CC2=C(C=C1)C(=O)C(=CO2)C1=CC(O)=C(O)C=C1 |
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| Average Molecular Weight | 270.2369 |
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| Monoisotopic Molecular Weight | 270.05282343 |
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| Chemical Taxonomy |
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| Class | Polyphenols |
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| Family | Isoflavones |
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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 | commercial |
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| Production Method Reference | Not Available |
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| Production Method Reference File | Not Available |
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| Quantity Available | 1 to 2 mg |
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| Delivery Time | 2 weeks |
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| Storage Form | powder |
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| Storage Conditions | 4°C |
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| Stability | Not Available |
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| Purity | >95% |
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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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| Claudine Manach | INRAE, Human Nutrition, Research Center Clermont-Auvergne-Rhône-Alpes, Clermont-Ferrand, FR, F-63122 | claudine.manach@inra.fr |
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| Commercial Vendors |
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| Cayman Chemical | 20930 |
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| Toronto Research Chemicals | T795200 |
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