| Record Information |
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| Version | 1.0 |
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| Creation date | 2018-04-16 08:32:53 UTC |
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| Update date | 2018-04-17 12:44:53 UTC |
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| FoodComEx ID | PC001120 |
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| FoodDB Record | FDB018285 |
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| Chemical Information |
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| Name | Rhoifolin |
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| Description | Isol. from Citrus aurantium (Seville orange). Rhoifolin is found in citrus, grapefruit/pummelo hybrid, german camomile, and lemon. |
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| CAS Number | 17306-46-6 |
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| Structure | |
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| Synonyms | | Synonym | Source |
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| (-)-Rhoifolin | biospider | | Apigenin 7-neohesperidoside | db_source | | Apigenin 7-O-neohesperidoside | biospider | | Rhoifolin | db_source | | Rhoifoloside | db_source |
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| Chemical Formula | C27H30O14 |
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| IUPAC name | 7-{[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one |
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| InChI Identifier | InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3 |
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| InChI Key | RPMNUQRUHXIGHK-UHFFFAOYSA-N |
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| Isomeric SMILES | CC1OC(OC2C(O)C(O)C(CO)OC2OC2=CC(O)=C3C(=O)C=C(OC3=C2)C2=CC=C(O)C=C2)C(O)C(O)C1O |
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| Average Molecular Weight | 578.5187 |
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| Monoisotopic Molecular Weight | 578.163555668 |
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| Chemical Taxonomy |
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| Class | Polyphenols |
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| Family | Flavones |
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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 | Mp 251-253° | DFC |
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| Foods of Origin |
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| Citrus, grapefruit/pummelo hybrid, german camomile, and lemon |
| 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 5 mg |
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| Delivery Time | 2 weeks |
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| Storage Form | powder |
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| Storage Conditions | RT |
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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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| AKSci | W1626 |
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| Toronto Research Chemicals | R414000 |
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