POA

PHOSPHONOACETALDEHYDE

Created:	2002-07-12
Last modified:	2024-09-27

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3 entries where POA is found as a standalone ligand2 entries where POA is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	12
Chiral Atom Count	0
Bond Count	11
Aromatic Bond Count	0

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Chemical Component Summary
Name	PHOSPHONOACETALDEHYDE
Systematic Name (OpenEye OEToolkits)	2-oxoethylphosphonic acid
Formula	C₂ H₅ O₄ P
Molecular Weight	124.032
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=CCP(=O)(O)O
SMILES	CACTVS	3.341	O[P](O)(=O)CC=O
SMILES	OpenEye OEToolkits	1.5.0	C(C=O)P(=O)(O)O
Canonical SMILES	CACTVS	3.341	O[P](O)(=O)CC=O
Canonical SMILES	OpenEye OEToolkits	1.5.0	C(C=O)P(=O)(O)O
InChI	InChI	1.03	InChI=1S/C2H5O4P/c3-1-2-7(4,5)6/h1H,2H2,(H2,4,5,6)
InChIKey	InChI	1.03	YEMKIGUKNDOZEG-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB03174
Name	Phosphonoacetaldehyde
Groups	experimental
Synonyms	Phosphonoacetaldehyde
Categories	Aldehydes

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Phosphonoacetaldehyde hydrolase	MKIEAVIFDWAGTTVDYGCFAPLEVFMEIFHKRGVAITAEEARKPMGLLK...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682