EFS

ETHYL DIHYDROGEN PHOSPHATE

Created:	2003-04-30
Last modified:	2024-09-27

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2 entries where EFS is found as a standalone ligand4 entries where EFS is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	14
Chiral Atom Count	0
Bond Count	13
Aromatic Bond Count	0

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Chemical Component Summary
Name	ETHYL DIHYDROGEN PHOSPHATE
Systematic Name (OpenEye OEToolkits)	ethyl dihydrogen phosphate
Formula	C₂ H₇ O₄ P
Molecular Weight	126.048
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=P(O)(O)OCC
SMILES	CACTVS	3.341	CCO[P](O)(O)=O
SMILES	OpenEye OEToolkits	1.5.0	CCOP(=O)(O)O
Canonical SMILES	CACTVS	3.341	CCO[P](O)(O)=O
Canonical SMILES	OpenEye OEToolkits	1.5.0	CCOP(=O)(O)O
InChI	InChI	1.03	InChI=1S/C2H7O4P/c1-2-6-7(3,4)5/h2H2,1H3,(H2,3,4,5)
InChIKey	InChI	1.03	ZJXZSIYSNXKHEA-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB03822
Name	Ethyl dihydrogen phosphate
Groups	experimental
Synonyms	Phosphoric acid monoethyl ester O-Ethyl dihydrogen phosphate Monoethyl acid phosphate Ethyl dihydrogen phosphate Monoethyl phosphate
Categories	Acids Acids, Noncarboxylic Anions Electrolytes Ions Organophosphorus Compounds Phosphoric Acids Phosphorus Acids Phosphorus Compounds
CAS number	1623-14-9

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Parathion hydrolase	MQTRRVVLKSAAAAGTLLGGLAGCASVAGSIGTGDRINTVRGPITISEAG...	unknown
Cholinesterase	MHSKVTIICIRFLFWFLLLCMLIGKSHTEDDIIIATKNGKVRGMNLTVFG...	unknown
Cholinesterase	MHSKVTIICIRFLFWFLLLCMLIGKSHTEDDIIIATKNGKVRGMNLTVFG...	unknown	ligand

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