| Record Information |
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| Version | 1.0 |
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| Creation Date | 2020-05-06 19:43:50 UTC |
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| Update Date | 2020-05-07 14:44:54 UTC |
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| BMDB ID | BMDB0109723 |
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| Secondary Accession Numbers | None |
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| Metabolite Identification |
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| Common Name | alpha-D-Psicofuranose |
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| Description | (2S,3R,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol 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 (2S,3R,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol is an extremely weak basic (essentially neutral) compound (based on its pKa). |
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| Structure | |
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| Synonyms | | Value | Source |
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| a-D-Psicofuranose | Generator | | Α-D-psicofuranose | Generator |
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| Chemical Formula | C6H12O6 |
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| Average Molecular Weight | 180.1559 |
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| Monoisotopic Molecular Weight | 180.063388116 |
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| IUPAC Name | (2S,3R,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol |
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| Traditional Name | (2S,3R,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol |
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| CAS Registry Number | Not Available |
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| SMILES | OC[C@H]1O[C@@](O)(CO)[C@H](O)[C@@H]1O |
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| InChI Identifier | InChI=1S/C6H12O6/c7-1-3-4(9)5(10)6(11,2-8)12-3/h3-5,7-11H,1-2H2/t3-,4-,5-,6+/m1/s1 |
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| InChI Key | RFSUNEUAIZKAJO-KAZBKCHUSA-N |
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| Chemical Taxonomy |
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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
- Pentose monosaccharide
- Monosaccharide
- Oxolane
- Secondary alcohol
- Hemiacetal
- 1,2-diol
- 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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| 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 | Not Available |
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| Physical Properties |
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| State | Not Available |
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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 | Not Available |
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