acompound

Showing entry for diisopropyl methylphosphonate

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0049336
Compound Name	diisopropyl methylphosphonate
Structure
Formula	C7H17O3P
InchiKey	WOAFDHWYKSOANX-UHFFFAOYSA-N
SMILES	CC(OP(=O)(OC(C)C)C)C
Inchi	InChI=1S/C7H17O3P/c1-6(2)9-11(5,8)10-7(3)4/h6-7H,1-5H3
IUPAC	2-[methyl(propan-2-yloxy)phosphoryl]oxypropane
Molecular Weight	180.09
Pubchem Id	3073
Chembl Id	CHEMBL1232236

Targets of Information Source

DrugBank

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type
P0A433	BXGT007030	Parathion hydrolase	reviewed	-	opd	experimental	-
P0A434	BXGT007031	Parathion hydrolase	reviewed	-	opd	experimental	-

PDB

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
P0A434	BXGT007031	Parathion hydrolase	reviewed	opd	-	-	-	-	-
P0A433	BXGT007030	Parathion hydrolase	reviewed	opd	-	-	-	-	-

Binding DB

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM

CHEMBL

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	width="10%">Type	Relation	value	Units
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Type	Relation	value	Units

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00081	Fig	Ficus carica	Fruits

The compound-realted diseases

Diseases

BXGD Id	Disease Name	CUI Disease Id	Disease Class Name	Number of targets^{?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease}