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Basic information
- CAS
1684-29-3- Standard SMILES
O=C(CO)[C@@H](O)[C@H](O)C(=O)CO- InChIKey
AWQIYVPBMVSGCL-PHDIDXHHSA-N- Molecular formula
- C6H10O6
- Average molar mass
- 178.14 g/mol
Overview
5-dehydro-D-fructose is a hexose obtained by selective dehydration at the 5-position of D-fructose. It is functionally related to a D-fructose.
Names & identifiers
- Preferred name
- 5-keto-D-Fructose
- IUPAC
- (3S,4S)-1,3,4,6-tetrahydroxyhexane-2,5-dione
Names & synonyms
5-Keto-D-fructose5-Ketofructose1684-29-3D-threo-2,5-HexodiuloseGRN7HJ7B3MNSC-2318235-oxofructoseRefChem:913483(1R,4R,7S,8S)-2,5-dioxabicyclo(2.2.2)octane-1,4,7,8-tetrol5-Dehydro-D-fructoseD-threo-hexo-2,5-diulose(3S,4S)-1,3,4,6-tetrahydroxyhexane-2,5-dione
Show more names
NSC 231823threo-2,5-HexodiuloseUNII-GRN7HJ7B3M5-OXOFRUCTOSE, D-5-KETOFRUCTOSE, D-5729-73-7SCHEMBL1292904CHEBI:17011
Database identifiers
- CAS
1684-29-3、5729-73-7- PubChem CID
- 99513
- ChEBI
CHEBI:17011- UNII
- GRN7HJ7B3M
- Nikkaji
- J92.810K
Properties
Computed structural propertiesFilling in
- XLogP
- -2.9
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 157
Related reactions
3 records
Compound notes
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