Showing entry for 4-Ethyl-gamma-butyrolactone


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0004161
Compound Name4-Ethyl-gamma-butyrolactone
Structure
FormulaC6H10O2
InchiKeyJBFHTYHTHYHCDJ-UHFFFAOYSA-N
SMILESCCC1CCC(=O)O1
InchiInChI=1S/C6H10O2/c1-2-5-3-4-6(7)8-5/h5H,2-4H2,1H3
IUPAC5-ethyloxolan-2-one
Molecular Weight114.14
Pubchem Id12756
Chembl IdCHEMBL192458
Targets of Information Source
DrugBank n.a
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
PDB n.a
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
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 CHEMBL192458
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
P05177 BXGT006336 Cytochrome P450 1A2 reviewed Enzyme CYP1A2 IC50 '=' 9900000 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00012 Pineapple Ananas comosus Fruits
BXGF00144 Apricot Prunus armeniaca Fruits
BXGF00149 Peach Prunus persica Fruits
BXGF00175 Potato Solanum tuberosum Vegetables
BXGF00806 Alcoholic beverages Beverages
BXGF00808 Pomes Fruits
BXGF00810 Cereals and cereal products Cereals and cereal products
BXGF00815 Milk and milk products Milk and milk products
BXGF00823 Fruits Fruits
BXGF01081 Akebia trifoliata Akebia trifoliata Medicinal Plant
BXGF02927 Akebia quinata Akebia quinata Medicinal Plant
BXGF03130 Panax quinquefolius Panax quinquefolius Medicinal Plant
BXGF04820 Panax ginseng Panax ginseng 0
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