| Record Information |
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| Version | 1.0 |
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| Creation date | 2010-04-08 22:10:00 UTC |
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| Update date | 2019-08-01 18:41:11 UTC |
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| Primary ID | FDB012129 |
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| Secondary Accession Numbers | Not Available |
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| Chemical Information |
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| FooDB Name | (±)-2'-Hydroxydihydrodaidzein |
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| Description | (±)-2'-Hydroxydihydrodaidzein, also known as 2',4',7-trihydroxyisoflavanone, belongs to the class of organic compounds known as isoflavanones. These are polycyclic compounds containing an isoflavan skeleton which bears a ketone at position C4. Thus, (±)-2'-hydroxydihydrodaidzein is considered to be a flavonoid (±)-2'-Hydroxydihydrodaidzein has been detected, but not quantified in, several different foods, such as new zealand spinaches (Tetragonia tetragonioides), feijoas (Feijoa sellowiana), kiwis (Actinidia chinensis), yellow wax beans (Phaseolus vulgaris), and black mulberries (Morus nigra). This could make (±)-2'-hydroxydihydrodaidzein a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on (±)-2'-Hydroxydihydrodaidzein. |
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| CAS Number | Not Available |
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| Structure | |
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| Synonyms | | Synonym | Source |
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| Not Available | Not Available |
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| Predicted Properties | Not Available |
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| Chemical Formula | C15H12O5 |
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| IUPAC name | |
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| InChI Identifier | InChI=1S/C15H12O5/c16-8-1-3-10(13(18)5-8)12-7-20-14-6-9(17)2-4-11(14)15(12)19/h1-6,12,16-18H,7H2 |
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| InChI Key | WBOWBLGZAXVREM-UHFFFAOYSA-N |
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| Isomeric SMILES | OC1=CC(O)=C(C=C1)C1COC2=C(C=CC(O)=C2)C1=O |
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| Average Molecular Weight | 272.2528 |
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| Monoisotopic Molecular Weight | 272.068473494 |
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| Classification |
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| Description | Belongs to the class of organic compounds known as isoflavanones. These are polycyclic compounds containing an isoflavan skeleton which bears a ketone at position C4. |
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| Kingdom | Organic compounds |
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| Super Class | Phenylpropanoids and polyketides |
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| Class | Isoflavonoids |
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| Sub Class | Isoflavans |
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| Direct Parent | Isoflavanones |
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| Alternative Parents | |
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| Substituents | - Isoflavanone
- Isoflavanol
- Hydroxyisoflavonoid
- Chromone
- 1-benzopyran
- Chromane
- Benzopyran
- Resorcinol
- Aryl ketone
- Aryl alkyl ketone
- Alkyl aryl ether
- 1-hydroxy-4-unsubstituted benzenoid
- Phenol
- 1-hydroxy-2-unsubstituted benzenoid
- Benzenoid
- Monocyclic benzene moiety
- Ketone
- Oxacycle
- Organoheterocyclic compound
- Ether
- Organic oxygen compound
- Hydrocarbon derivative
- Organic oxide
- Organooxygen compound
- Aromatic heteropolycyclic compound
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| Molecular Framework | Aromatic heteropolycyclic compounds |
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| External Descriptors | |
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| Ontology |
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| Ontology | No ontology term |
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| Physico-Chemical Properties |
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| Physico-Chemical Properties - Experimental | | Property | Value | Reference |
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| Physical state | Not Available | |
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| Physical Description | Not Available | |
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| Mass Composition | C 66.17%; H 4.44%; O 29.38% | DFC |
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| Melting Point | Not Available | |
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| Boiling Point | Not Available | |
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| Experimental Water Solubility | Not Available | |
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| Experimental logP | Not Available | |
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| Experimental pKa | Not Available | |
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| Isoelectric point | Not Available | |
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| Charge | Not Available | |
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| Optical Rotation | Not Available | |
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| Spectroscopic UV Data | Not Available | |
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| Density | Not Available | |
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| Refractive Index | Not Available | |
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| Spectra |
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| Spectra | |
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| EI-MS/GC-MS | Not Available |
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| MS/MS | Not Available |
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| NMR | Not Available |
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| External Links |
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| ChemSpider ID | 389058 |
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| ChEMBL ID | Not Available |
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| KEGG Compound ID | C03567 |
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| Pubchem Compound ID | 440047 |
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| Pubchem Substance ID | Not Available |
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| ChEBI ID | Not Available |
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| Phenol-Explorer ID | Not Available |
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| DrugBank ID | Not Available |
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| HMDB ID | HMDB33928 |
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| CRC / DFC (Dictionary of Food Compounds) ID | HDM21-G:HDM22-H |
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| EAFUS ID | Not Available |
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| Dr. Duke ID | Not Available |
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| BIGG ID | Not Available |
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| KNApSAcK ID | Not Available |
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| HET ID | Not Available |
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| Food Biomarker Ontology | Not Available |
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| VMH ID | Not Available |
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| Flavornet ID | Not Available |
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| GoodScent ID | Not Available |
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| SuperScent ID | Not Available |
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| Wikipedia ID | Not Available |
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| Phenol-Explorer Metabolite ID | Not Available |
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| Duplicate IDS | Not Available |
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| Old DFC IDS | Not Available |
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| Associated Foods |
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| Food | Content Range | Average | Reference |
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| Food | | | Reference |
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| Biological Effects and Interactions |
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| Health Effects / Bioactivities | Not Available |
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| Enzymes | Not Available |
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| Pathways | Not Available |
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| Metabolism | Not Available |
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| Biosynthesis | Not Available |
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| Organoleptic Properties |
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| Flavours | Not Available |
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| Files |
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| MSDS | Not Available |
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| References |
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| Synthesis Reference | Not Available |
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| General Reference | Not Available |
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| Content Reference | |
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