MiMeDB: Showing metabocard for D-galactono-1,4-lactone (MMDBc0054429)

Xenobiotic

Record Information

Version

2.0

Status

Detected and Quantified

Creation Date

2022-06-05 23:11:58 UTC

Update Date

2025-10-07 16:08:30 UTC

Metabolite ID

MMDBc0054429

Metabolite Identification

Common Name

D-galactono-1,4-lactone

Description

D-galactono-1,4-lactone is a lactone and a metabolite involved in various glycosylation reactions. Its chemical structure features a cyclic ester formed from D-galactonic acid, which plays a significant role in carbohydrate chemistry. D-galactono-1,4-lactone serves as a substrate for the synthesis of glycosyl derivatives, as demonstrated in studies where it was utilized alongside other acceptors for glycosylation reactions (PMID:22050997 ). Furthermore, it has been employed in the preparation of other derivatives, such as 2,3,4,6-tetra-O-methyl-D-galactonic acid (PMID:17097075 ). Notably, D-galactono-1,4-lactone is implicated in enzymatic pathways, where it acts as an inhibitor for beta-D-galactofuranosidase produced by Penicillium fellutanum, affecting the synthesis of galactofuranose in cell walls (PMID:12007471 ). Additionally, it has been involved in photochemical reactions, including electron transfer and alpha-deoxygenation processes (PMID:12433476 ). Overall, D-galactono-1,4-lactone is a significant compound in carbohydrate chemistry with various applications in synthetic and enzymatic pathways.

Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Molecular Formula

C₆H₁₀O₆

Average Mass

178.14

Monoisotopic Mass

178.047738052

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C6H10O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2-5,7-10H,1H2/t2-,3-,4-,5+/m1/s1

InChI Key

SXZYCXMUPBBULW-AIHAYLRMSA-N

Chemical Taxonomy

Functional Ontology

Not Available

Physical Properties

State

Expected Solid

Predicted Properties

Not Available

Spectra

Not Available

Chromatographic Retention Times and Retention Indices

Retention Times

Not Available

Retention Indices

Chromatography Type	Peak Label	SMILES	Stationary Phase	Deposition Date	Retention Index
Gas Chromatography	D-galactono-1,4-lactone_TMS_1	C[Si](C)(C)O[C@H](CO)[C@@H]1OC(=O)[C@H](O)[C@H]1O	standard non polar	2025-10-24	2137.42
Gas Chromatography	D-galactono-1,4-lactone_TMS_2	C[Si](C)(C)OC[C@@H](O)[C@@H]1OC(=O)[C@H](O)[C@H]1O	standard non polar	2025-10-24	1780.83
Gas Chromatography	D-galactono-1,4-lactone_TMS_3	C[Si](C)(C)O[C@H]1C(=O)O[C@@H]([C@H](O)CO)[C@@H]1O	standard non polar	2025-10-24	1758.03
Gas Chromatography	D-galactono-1,4-lactone_TMS_4	C[Si](C)(C)O[C@H]1[C@H]([C@H](O)CO)OC(=O)[C@@H]1O	standard non polar	2025-10-24	2344.87
Gas Chromatography	D-galactono-1,4-lactone_TMS_5	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H]1OC(=O)[C@H](O)[C@H]1O	standard non polar	2025-10-24	2010.01
Gas Chromatography	D-galactono-1,4-lactone_TMS_6	C[Si](C)(C)O[C@H]1C(=O)O[C@@H]([C@@H](CO)O[Si](C)(C)C)[C@@H]1O	standard non polar	2025-10-24	1859.81
Gas Chromatography	D-galactono-1,4-lactone_TMS_7	C[Si](C)(C)O[C@H](CO)[C@@H]1OC(=O)[C@H](O)[C@H]1O[Si](C)(C)C	standard non polar	2025-10-24	2126.38
Gas Chromatography	D-galactono-1,4-lactone_TMS_8	C[Si](C)(C)OC[C@@H](O)[C@@H]1OC(=O)[C@H](O[Si](C)(C)C)[C@H]1O	standard non polar	2025-10-24	1713.36
Gas Chromatography	D-galactono-1,4-lactone_TMS_9	C[Si](C)(C)OC[C@@H](O)[C@@H]1OC(=O)[C@H](O)[C@H]1O[Si](C)(C)C	standard non polar	2025-10-24	2028.88
Gas Chromatography	D-galactono-1,4-lactone_TMS_10	C[Si](C)(C)O[C@H]1[C@H]([C@H](O)CO)OC(=O)[C@@H]1O[Si](C)(C)C	standard non polar	2025-10-24	1665.34
Gas Chromatography	D-galactono-1,4-lactone_TMS_11	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H]1OC(=O)[C@H](O[Si](C)(C)C)[C@H]1O	standard non polar	2025-10-24	1854.48
Gas Chromatography	D-galactono-1,4-lactone_TMS_12	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H]1OC(=O)[C@H](O)[C@H]1O[Si](C)(C)C	standard non polar	2025-10-24	1983.48
Gas Chromatography	D-galactono-1,4-lactone_TMS_13	C[Si](C)(C)O[C@H]1[C@H]([C@@H](CO)O[Si](C)(C)C)OC(=O)[C@@H]1O[Si](C)(C)C	standard non polar	2025-10-24	2007.67
Gas Chromatography	D-galactono-1,4-lactone_TMS_14	C[Si](C)(C)OC[C@@H](O)[C@@H]1OC(=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	standard non polar	2025-10-24	1967.09
Gas Chromatography	D-galactono-1,4-lactone_TMS_15	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H]1OC(=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	standard non polar	2025-10-24	1944.21
Gas Chromatography	D-galactono-1,4-lactone_TMS_1	C[Si](C)(C)O[C@H](CO)[C@@H]1OC(=O)[C@H](O)[C@H]1O	standard polar	2025-10-24	2182.79
Gas Chromatography	D-galactono-1,4-lactone_TMS_2	C[Si](C)(C)OC[C@@H](O)[C@@H]1OC(=O)[C@H](O)[C@H]1O	standard polar	2025-10-24	1713.47
Gas Chromatography	D-galactono-1,4-lactone_TMS_3	C[Si](C)(C)O[C@H]1C(=O)O[C@@H]([C@H](O)CO)[C@@H]1O	standard polar	2025-10-24	2242.82
Gas Chromatography	D-galactono-1,4-lactone_TMS_4	C[Si](C)(C)O[C@H]1[C@H]([C@H](O)CO)OC(=O)[C@@H]1O	standard polar	2025-10-24	1977.59
Gas Chromatography	D-galactono-1,4-lactone_TMS_5	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H]1OC(=O)[C@H](O)[C@H]1O	standard polar	2025-10-24	2030.08
Gas Chromatography	D-galactono-1,4-lactone_TMS_6	C[Si](C)(C)O[C@H]1C(=O)O[C@@H]([C@@H](CO)O[Si](C)(C)C)[C@@H]1O	standard polar	2025-10-24	1921.96
Gas Chromatography	D-galactono-1,4-lactone_TMS_7	C[Si](C)(C)O[C@H](CO)[C@@H]1OC(=O)[C@H](O)[C@H]1O[Si](C)(C)C	standard polar	2025-10-24	1935.45
Gas Chromatography	D-galactono-1,4-lactone_TMS_8	C[Si](C)(C)OC[C@@H](O)[C@@H]1OC(=O)[C@H](O[Si](C)(C)C)[C@H]1O	standard polar	2025-10-24	2521.68
Gas Chromatography	D-galactono-1,4-lactone_TMS_9	C[Si](C)(C)OC[C@@H](O)[C@@H]1OC(=O)[C@H](O)[C@H]1O[Si](C)(C)C	standard polar	2025-10-24	2535.62
Gas Chromatography	D-galactono-1,4-lactone_TMS_10	C[Si](C)(C)O[C@H]1[C@H]([C@H](O)CO)OC(=O)[C@@H]1O[Si](C)(C)C	standard polar	2025-10-24	1951.31
Gas Chromatography	D-galactono-1,4-lactone_TMS_11	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H]1OC(=O)[C@H](O[Si](C)(C)C)[C@H]1O	standard polar	2025-10-24	2537.58
Gas Chromatography	D-galactono-1,4-lactone_TMS_12	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H]1OC(=O)[C@H](O)[C@H]1O[Si](C)(C)C	standard polar	2025-10-24	1893.51
Gas Chromatography	D-galactono-1,4-lactone_TMS_13	C[Si](C)(C)O[C@H]1[C@H]([C@@H](CO)O[Si](C)(C)C)OC(=O)[C@@H]1O[Si](C)(C)C	standard polar	2025-10-24	1947.12
Gas Chromatography	D-galactono-1,4-lactone_TMS_14	C[Si](C)(C)OC[C@@H](O)[C@@H]1OC(=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	standard polar	2025-10-24	1617.95
Gas Chromatography	D-galactono-1,4-lactone_TMS_15	C[Si](C)(C)OC[C@@H](O[Si](C)(C)C)[C@@H]1OC(=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	standard polar	2025-10-24	1596.21

Biological Properties

Cellular Locations

Not Available

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Associated OMIM IDs

114500 (Colorectal cancer)
610247 (Eosinophilic esophagitis)

Human Proteins and Enzymes

Protein ID	Protein Name	Protein Type	Uniprot ID	Species

Human Pathways

Pathways

Name	SMPDB/PathBank

Microbial Pathways

Pathways

Not Available

Metabolic Reactions

Reactions

This table shows at most 20 reactions. For the full list of associated reactions:

See All Associated Reactions

Reaction ID	Precursor	Product	Enzyme	Reaction Type	Data Source	Reference

Health Effects and Bioactivity

Health Outcome/Bioactivity	Metabolite Response/Effect	Evidence Type	Host and Biospecimen	Data Source	Reference

Microbial Sources

Superkingdom/Kingdom	Phylum	Total species	Hosts and Body Sites
Bacteria	Proteobacteria	1	Human ; Human subgingival plaque
Bacteria/Eubacteria	Proteobacteria	1	Human ; Human subgingival plaque
Archaea	Crenarchaeota	1	Human feces
Archaea/Archaea	Euryarchaeota	1

Exposure Sources

Other Exposures

Source Type	Data Source	Reference
Cosmetics	U.S. Environmental Protection Agency	CompTox
Domestics	U.S. Environmental Protection Agency	CompTox
Cosmetics	U.S. Environmental Protection Agency	CompTox

Host Biospecimen and Location

Host and Biospecimen	Status	Mean	Std	Min	Max	Units	Age	Sex	Health Condition	Data Source	Reference

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

Not Available

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

Not Available

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

CMMC Knowledgebase

Not Available

General References

Bansal P, Morgat A, Axelsen KB, Muthukrishnan V, Coudert E, Aimo L, Hyka-Nouspikel N, Gasteiger E, Kerhornou A, Neto TB, Pozzato M, Blatter MC, Ignatchenko A, Redaschi N, Bridge A: Rhea, the reaction knowledgebase in 2022. Nucleic Acids Res. 2022 Jan 7;50(D1):D693-D700. doi: 10.1093/nar/gkab1016. [PubMed:34755880 ]

Showing metabocard for D-galactono-1,4-lactone (MMDBc0054429)

MOL for #<Metabolite:0x00007fade3053dc0>

3D MOL for #<Metabolite:0x00007fade3053dc0>

3D SDF for #<Metabolite:0x00007fade3053dc0>

3D-SDF for #<Metabolite:0x00007fade3053dc0>

PDB for #<Metabolite:0x00007fade3053dc0>

3D PDB for #<Metabolite:0x00007fade3053dc0>

SMILES for #<Metabolite:0x00007fade3053dc0>

INCHI for #<Metabolite:0x00007fade3053dc0>

Structure for #<Metabolite:0x00007fade3053dc0>

3D Structure for #<Metabolite:0x00007fade3053dc0>