| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-09-30 22:34:07 UTC |
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| Update Date | 2020-05-05 18:39:51 UTC |
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| BMDB ID | BMDB0000640 |
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| Secondary Accession Numbers | |
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| Metabolite Identification |
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| Common Name | Glucosan |
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| Description | Levoglucosan belongs to the class of organic compounds known as oxepanes. Oxepanes are compounds containing an oxepane ring, which is a seven-member saturated aliphatic heterocycle with one oxygen and six carbon atoms. Levoglucosan exists in all eukaryotes, ranging from yeast to plants to humans. Based on a literature review a significant number of articles have been published on Levoglucosan. |
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| Structure | |
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| Synonyms | | Value | Source |
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| 1,6-Anhydro-beta-D-glucose | ChEBI | | 1,6-Anhydro-beta-glucopyranose | ChEBI | | 1,6-Anhydroglucose | ChEBI | | Glucosan | ChEBI | | Leucoglucosan | ChEBI | | 1,6-Anhydro-b-D-glucose | Generator | | 1,6-Anhydro-β-D-glucose | Generator | | 1,6-Anhydro-b-glucopyranose | Generator | | 1,6-Anhydro-β-glucopyranose | Generator | | 1,6-Anhydro-b-D-glucopyranose | HMDB | | 1,6-Anhydro-beta-D-glucopyranose | HMDB | | 1,6-Anhydro-beta-delta-glucopyranose | HMDB | | 1,6-Anhydro-beta-delta-glucose | HMDB | | 1,6-Anhydro-D-glucose | HMDB | | 1,6-Anhydro-delta-glucose | HMDB | | 6,8-Dioxabicyclo[3.2.1]octane b-D-glucopyranose deriv. | HMDB | | 6,8-Dioxabicyclo[3.2.1]octane b-delta-glucopyranose deriv. | HMDB | | Anhydro-D-mannosan | HMDB | | Anhydro-delta-mannosan | HMDB | | L-Glucosan | HMDB |
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| Chemical Formula | C6H10O5 |
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| Average Molecular Weight | 162.1406 |
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| Monoisotopic Molecular Weight | 162.05282343 |
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| IUPAC Name | (1R,2S,3S,4R,5R)-6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol |
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| Traditional Name | levoglucosan |
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| CAS Registry Number | 498-07-7 |
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| SMILES | [H][C@@]12OC[C@@H](O1)[C@@H](O)[C@H](O)[C@H]2O |
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| InChI Identifier | InChI=1S/C6H10O5/c7-3-2-1-10-6(11-2)5(9)4(3)8/h2-9H,1H2/t2-,3-,4+,5-,6-/m1/s1 |
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| InChI Key | TWNIBLMWSKIRAT-VFUOTHLCSA-N |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as oxepanes. Oxepanes are compounds containing an oxepane ring, which is a seven-member saturated aliphatic heterocycle with one oxygen and six carbon atoms. |
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| Kingdom | Organic compounds |
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| Super Class | Organoheterocyclic compounds |
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| Class | Oxepanes |
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| Sub Class | Not Available |
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| Direct Parent | Oxepanes |
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| Alternative Parents | |
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| Substituents | - Oxepane
- Oxane
- Monosaccharide
- Meta-dioxolane
- Secondary alcohol
- Oxacycle
- Polyol
- Acetal
- Organic oxygen compound
- Hydrocarbon derivative
- Organooxygen compound
- Alcohol
- Aliphatic heteropolycyclic compound
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| Molecular Framework | Aliphatic heteropolycyclic compounds |
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| External Descriptors | |
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| Ontology |
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| Status | Detected but not Quantified |
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| Origin | Not Available |
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| Biofunction | Not Available |
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| Application | Not Available |
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| Cellular locations | |
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| Physical Properties |
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| State | Solid |
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| Experimental Properties | | Property | Value | Reference |
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| Melting Point | Not Available | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | LogP | Not Available | Not Available |
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| Predicted Properties | |
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| Spectra |
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| Spectra | |
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