| Record Information |
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| Version | 1.0 |
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| Creation date | 2010-04-08 22:10:06 UTC |
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| Update date | 2019-11-26 03:06:34 UTC |
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| Primary ID | FDB012324 |
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| Secondary Accession Numbers | Not Available |
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| Chemical Information |
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| FooDB Name | D-erythro-L-gluco-Nonulose |
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| Description | D-erythro-L-galacto-Nonulose belongs to the class of organic compounds known as c-glycosyl compounds. These are glycoside in which a sugar group is bonded through one carbon to another group via a C-glycosidic bond. D-erythro-L-galacto-Nonulose has been detected, but not quantified in, avocados (Persea americana) and fruits. This could make D-erythro-L-galacto-nonulose a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on D-erythro-L-galacto-Nonulose. |
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| CAS Number | Not Available |
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| Structure | |
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| Synonyms | |
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| Predicted Properties | |
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| Chemical Formula | C9H18O9 |
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| IUPAC name | 2-(hydroxymethyl)-6-(1,2,3-trihydroxypropyl)oxane-2,3,4,5-tetrol |
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| InChI Identifier | InChI=1S/C9H18O9/c10-1-3(12)4(13)7-5(14)6(15)8(16)9(17,2-11)18-7/h3-8,10-17H,1-2H2 |
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| InChI Key | USEZWDIVUDJKCA-UHFFFAOYSA-N |
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| Isomeric SMILES | OCC(O)C(O)C1OC(O)(CO)C(O)C(O)C1O |
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| Average Molecular Weight | 270.2338 |
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| Monoisotopic Molecular Weight | 270.095082174 |
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| Classification |
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| Description | Belongs to the class of organic compounds known as c-glycosyl compounds. These are glycoside in which a sugar group is bonded through one carbon to another group via a C-glycosidic bond. |
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| Kingdom | Organic compounds |
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| Super Class | Organic oxygen compounds |
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| Class | Organooxygen compounds |
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| Sub Class | Carbohydrates and carbohydrate conjugates |
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| Direct Parent | C-glycosyl compounds |
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| Alternative Parents | |
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| Substituents | - C-glycosyl compound
- Oxane
- Monosaccharide
- Secondary alcohol
- Hemiacetal
- Oxacycle
- Organoheterocyclic compound
- Polyol
- Hydrocarbon derivative
- Primary alcohol
- Alcohol
- Aliphatic heteromonocyclic compound
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| Molecular Framework | Aliphatic heteromonocyclic compounds |
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| External Descriptors | Not Available |
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| Ontology |
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| Disposition | Route of exposure: Source: |
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| Role | Biological role: |
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| Physico-Chemical Properties |
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| Physico-Chemical Properties - Experimental | |
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| Spectra |
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| Spectra | |
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| EI-MS/GC-MS | | Type | Description | Splash Key | View |
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| Predicted GC-MS | D-erythro-L-gluco-Nonulose, non-derivatized, Predicted GC-MS Spectrum - 70eV, Positive | splash10-0pbi-9370000000-466064f1e743a8cc34c1 | Spectrum | | Predicted GC-MS | D-erythro-L-gluco-Nonulose, 5 TMS, Predicted GC-MS Spectrum - 70eV, Positive | splash10-014i-2024149000-f9524ce5e0941126be42 | Spectrum | | Predicted GC-MS | D-erythro-L-gluco-Nonulose, non-derivatized, Predicted GC-MS Spectrum - 70eV, Positive | Not Available | Spectrum | | Predicted GC-MS | D-erythro-L-gluco-Nonulose, non-derivatized, Predicted GC-MS Spectrum - 70eV, Positive | Not Available | Spectrum |
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| MS/MS | | Type | Description | Splash Key | View |
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| Predicted MS/MS | Predicted LC-MS/MS Spectrum - 10V, Positive | splash10-0fk9-1290000000-09e5658f74d38950e779 | 2016-06-03 | View Spectrum | | Predicted MS/MS | Predicted LC-MS/MS Spectrum - 20V, Positive | splash10-03di-9330000000-457c7d709d9d2cdea97d | 2016-06-03 | View Spectrum | | Predicted MS/MS | Predicted LC-MS/MS Spectrum - 40V, Positive | splash10-03di-9400000000-a4187d642750da7c8d4d | 2016-06-03 | View Spectrum | | Predicted MS/MS | Predicted LC-MS/MS Spectrum - 10V, Negative | splash10-100r-6930000000-8239ee32387b419064bf | 2016-08-03 | View Spectrum | | Predicted MS/MS | Predicted LC-MS/MS Spectrum - 20V, Negative | splash10-0zml-9720000000-9c8350a8a8f50ff62011 | 2016-08-03 | View Spectrum | | Predicted MS/MS | Predicted LC-MS/MS Spectrum - 40V, Negative | splash10-06xx-9300000000-c92c66682dc18c776363 | 2016-08-03 | View Spectrum | | Predicted MS/MS | Predicted LC-MS/MS Spectrum - 10V, Positive | splash10-0fk9-0090000000-b7ab93b832cefc13b029 | 2021-09-22 | View Spectrum | | Predicted MS/MS | Predicted LC-MS/MS Spectrum - 20V, Positive | splash10-0fk9-2290000000-515903613e37db8fb3c4 | 2021-09-22 | View Spectrum | | Predicted MS/MS | Predicted LC-MS/MS Spectrum - 40V, Positive | splash10-01xw-9100000000-3dfd013bce999a7c4e98 | 2021-09-22 | View Spectrum | | Predicted MS/MS | Predicted LC-MS/MS Spectrum - 10V, Negative | splash10-014i-1190000000-e1bd02c790f46b6c86ac | 2021-09-22 | View Spectrum | | Predicted MS/MS | Predicted LC-MS/MS Spectrum - 20V, Negative | splash10-0a4i-9670000000-e0dce88e7b58ca36f044 | 2021-09-22 | View Spectrum | | Predicted MS/MS | Predicted LC-MS/MS Spectrum - 40V, Negative | splash10-0a4l-9000000000-3f387a38d6ca07acd972 | 2021-09-22 | View Spectrum |
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| NMR | Not Available |
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| External Links |
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| ChemSpider ID | Not Available |
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| ChEMBL ID | Not Available |
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| KEGG Compound ID | Not Available |
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| Pubchem Compound ID | Not Available |
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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 | HMDB29955 |
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| CRC / DFC (Dictionary of Food Compounds) ID | HGH85-Y:HGH85-Y |
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| EAFUS ID | Not Available |
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| Dr. Duke ID | D-ERYTHRO-L-GLUCO-NONULOSE |
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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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| 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 | — Duke, James. 'Dr. Duke's Phytochemical and Ethnobotanical Databases. United States Department of Agriculture.' Agricultural Research Service, Accessed April 27 (2004).
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