Identidade

5-Ketogluconic acid

Não indicado · C6H10O7

01Identidade

Lazychem ID	LC-84658
CAS RN	Não indicado
PubChem CID	5460352
Molecular formula	C6H10O7
Molecular weight	194.14 g/mol
IUPAC name	(2R,3S,4S)-2,3,4,6-tetrahydroxy-5-oxohexanoic acid
InChIKey	IZSRJDGCGRAUAR-MROZADKFSA-N

02Estrutura e estereoquímica

Two-dimensional chemical structure of 5-Ketogluconic acid — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure is acyclic, includes aliphatic carbon, has 3 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres	3
Ring count	0
Secondary amines	0
Tertiary amines	0

SMILES	C(C(=O)[C@H]([C@@H]([C@H](C(=O)O)O)O)O)O
InChI	Não indicado

03Stereochemistry

The published structure contains 3 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres3Structure assigned

Unassigned centres0Structure unspecified

Assignment statusFully assignedExact published identity

Tetrahedral upper bound≤ 8Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.