MiMeDB: Showing metabocard for Phosphonoacetate (MMDBc0030377)

Record Information

Version

1.0

Status

Detected and Quantified

Creation Date

2021-11-18 00:05:52 UTC

Update Date

2022-08-31 17:49:51 UTC

Metabolite ID

MMDBc0030377

Metabolite Identification

Common Name

Phosphonoacetate

Description

A simple organophosphorus compound that inhibits DNA polymerase, especially in viruses and is used as an antiviral agent.

Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Molecular Formula

C₂H₅O₅P

Average Mass

140.0319

Monoisotopic Mass

139.987459782

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

4408-78-0

SMILES

Not Available

InChI Identifier

InChI=1S/C2H5O5P/c3-2(4)1-8(5,6)7/h1H2,(H,3,4)(H2,5,6,7)

InChI Key

XUYJLQHKOGNDPB-UHFFFAOYSA-N

Chemical Taxonomy

Functional Ontology

Not Available

Physical Properties

State

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

Cytoplasm

Biospecimen Locations

Fibroblasts

Tissue Locations

Fibroblasts

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	Microbial Links
Bacteria	Proteobacteria	5	Human ; Human feces; Human feces; pleural fluid plaque; bal	Unknown
Eukaryota/Fungi	Ascomycota	1

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 Fibroblasts	Detected but not Quantified						Not Specified	Not Specified	Normal	HMDB	34986597

External Links

Not Available

General References

Sairenji T, Hinuma Y, Sekizawa T, Yoshida M: Appearance of early and late components of Epstein-Barr virus-associated membrane antigen in Daudi cells superinfected with P3HR-1 virus. J Gen Virol. 1978 Jan;38(1):111-20. doi: 10.1099/0022-1317-38-1-111. [PubMed:202665 ]
Abendroth A, Lin I, Slobedman B, Ploegh H, Arvin AM: Varicella-zoster virus retains major histocompatibility complex class I proteins in the Golgi compartment of infected cells. J Virol. 2001 May;75(10):4878-88. doi: 10.1128/JVI.75.10.4878-4888.2001. [PubMed:11312359 ]

Showing metabocard for Phosphonoacetate (MMDBc0030377)

MOL for #<Metabolite:0x00007f1240e57208>

3D MOL for #<Metabolite:0x00007f1240e57208>

3D SDF for #<Metabolite:0x00007f1240e57208>

3D-SDF for #<Metabolite:0x00007f1240e57208>

PDB for #<Metabolite:0x00007f1240e57208>

3D PDB for #<Metabolite:0x00007f1240e57208>

SMILES for #<Metabolite:0x00007f1240e57208>

INCHI for #<Metabolite:0x00007f1240e57208>

Structure for #<Metabolite:0x00007f1240e57208>

3D Structure for #<Metabolite:0x00007f1240e57208>