Products 10534-44-8
CAS 10534-44-8 appears in our catalog under these names: 3-Dehydroquinic acid, (1R,3R,4S)-1,3,4-Trihydroxy-5-oxocyclohexanecarboxylic acid, 95+%. Offered by: Chemat Brand, TRC. Available pack sizes: on request, 250mg.
3-dehydroquinic acid is a 4-oxo monocarboxylic acid derived from quinic acid by oxidation of the hydroxy group at position 3 to the corresponding keto group. It has a role as an Escherichia coli metabolite. It is a secondary alpha-hydroxy ketone, a 4-oxo monocarboxylic acid, a 4-hydroxy monocarboxylic acid, a 5-hydroxy monocarboxylic acid and a 2-hydroxy monocarboxylic acid. It is functionally related to a (-)-quinic acid. It is a conjugate acid of a 3-dehydroquinate.
Source: ChEBI
| Molecular formula | C7H10O6 |
|---|---|
| Molecular weight | 190.15 g/mol |
| IUPAC name | (1R,3R,4S)-1,3,4-trihydroxy-5-oxocyclohexane-1-carboxylic acid |
| InChIKey | WVMWZWGZRAXUBK-SYTVJDICSA-N |
| SMILES | C1[C@H]([C@@H](C(=O)C[C@]1(C(=O)O)O)O)O |
Computed by PubChem (NCBI)
Synonyms:
3-dehydroquinic acid, 5-dehydroquinic acid, (1R,3R,4S)-1,3,4-Trihydroxy-5-oxocyclohexanecarboxylic acid, 3-dehydroquinate, (1R,3R,4S)-1,3,4-trihydroxy-5-oxocyclohexane-1-carboxylic acid, 5-dehydroquinate, Cyclohexanecarboxylic acid, 1,3,4-trihydroxy-5-oxo-, (1R,3R,4S)-, Cyclohexan-1,4,5-triol-3-one-1-carboxylic acid, 1,3beta,4alpha-Trihydroxy-5-oxocyclohexane-1beta-carboxylic acid, WVMWZWGZRAXUBK-SYTVJDICSA-N