MiMeDB: Showing metabocard for Phosphonoacetaldehyde (MMDBc0048262)

Record Information

Version

1.0

Status

Detected and Quantified

Creation Date

2022-04-29 21:54:59 UTC

Update Date

2022-09-01 02:14:30 UTC

Metabolite ID

MMDBc0048262

Metabolite Identification

Common Name

Phosphonoacetaldehyde

Description

Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Molecular Formula

C₂H₅O₄P

Average Mass

124.0325

Monoisotopic Mass

123.99254516

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C2H5O4P/c3-1-2-7(4,5)6/h1H,2H2,(H2,4,5,6)

InChI Key

YEMKIGUKNDOZEG-UHFFFAOYSA-N

Chemical Taxonomy

Functional Ontology

Not Available

Physical Properties

State

Expected Solid

Predicted Properties

Not Available

Spectra

Chromatographic Retention Times and Retention Indices

Retention Times

Not Available

Retention Indices

Not Available

Chromatographic Retention Times and Retention Indices

Retention Times

Not Available

Retention Indices

Not Available

Biological Properties

Cellular Locations

Not Available

Biospecimen Locations

Feces

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
MMDBp0114881	Bifunctional phosphonoacetaldehyde hydrolase/aminoethylphosphonate transaminase	Enzyme	Q183T0	Clostridioides difficile (strain 630) (Peptoclostridium difficile).
MMDBp0147561	Phosphonoacetaldehyde hydrolase	Enzyme	Q5PFR1	Salmonella paratyphi A (strain ATCC 9150 / SARB42).
MMDBp0022924	2-aminoethylphosphonate--pyruvate transaminase	Enzyme	A6L4N0	Phocaeicola vulgatus (strain ATCC 8482 / DSM 1447 / JCM 5826 / CCUG 4940 /NBRC 14291 / NCTC 11154) (Bacteroides vulgatus).
MMDBp0147560	2-aminoethylphosphonate--pyruvate transaminase	Enzyme	Q5PFR0	Salmonella paratyphi A (strain ATCC 9150 / SARB42).
MMDBp0023069	Phosphonoacetaldehyde hydrolase	Enzyme	A6LFV1	Parabacteroides distasonis (strain ATCC 8503 / DSM 20701 / CIP 104284 / JCM5825 / NCTC 11152).

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	Microbial Links
Bacteria	Proteobacteria	113	Human feces; Human sputum; Human ; Turkey	Metabolic reconstruction
Bacteria	Firmicutes	83	Human feces; Human	Metabolic reconstruction
Bacteria	Actinobacteria	13	Human feces; Human	Metabolic reconstruction
Bacteria	Bacteroidetes	51	Human feces; Human	Metabolic reconstruction
Bacteria	Fusobacteria	4	Human feces	Metabolic reconstruction
Bacteria	Synergistetes	1	Human feces	Metabolic reconstruction
Eukaryota/Fungi	Ascomycota	1		Metabolic reconstruction
Archaea	Crenarchaeota	1	Human feces	Metabolic reconstruction
Bacteria/NULL	Proteobacteria	1	Human feces; Human sputum; Human ; Turkey	Metabolic reconstruction
Bacteria/NULL	Actinobacteria	1	Human feces; Human	Metabolic reconstruction

Exposure Sources

Other Exposures

Source Type	Data Source	Reference

Host Biospecimen and Location

Host and Biospecimen	Status	Mean	Std	Min	Max	Units	Age	Sex	Health Condition	Data Source	Reference
Human Feces	Detected but not Quantified									HMDB

External Links

Not Available

General References

Barupal DK, Fiehn O: Generating the Blood Exposome Database Using a Comprehensive Text Mining and Database Fusion Approach. Environ Health Perspect. 2019 Sep;127(9):97008. doi: 10.1289/EHP4713. Epub 2019 Sep 26. [PubMed:31557052 ]

Showing metabocard for Phosphonoacetaldehyde (MMDBc0048262)

MOL for #<Metabolite:0x00007f1240cc2fc8>

3D MOL for #<Metabolite:0x00007f1240cc2fc8>

3D SDF for #<Metabolite:0x00007f1240cc2fc8>

3D-SDF for #<Metabolite:0x00007f1240cc2fc8>

PDB for #<Metabolite:0x00007f1240cc2fc8>

3D PDB for #<Metabolite:0x00007f1240cc2fc8>

SMILES for #<Metabolite:0x00007f1240cc2fc8>

INCHI for #<Metabolite:0x00007f1240cc2fc8>

Structure for #<Metabolite:0x00007f1240cc2fc8>

3D Structure for #<Metabolite:0x00007f1240cc2fc8>