Showing entry for 2-Ethylbutanal


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0002403
Compound Name2-Ethylbutanal
Structure
FormulaC6H12O
InchiKeyUNNGUFMVYQJGTD-UHFFFAOYSA-N
SMILESCCC(CC)C=O
InchiInChI=1S/C6H12O/c1-3-6(4-2)5-7/h5-6H,3-4H2,1-2H3
IUPAC2-ethylbutanal
Molecular Weight100.16
Pubchem Id7359
Chembl IdCHEMBL273782
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 50028843
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
reviewed BXGT007632 Phenylethanolamine N-methyltransferase reviewed PNMT - 545000 - -
CHEMBL CHEMBL273782
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
P10938 BXGT007632 Phenylethanolamine N-methyltransferase reviewed - PNMT IC50 '=' 545000 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00175 Potato Solanum tuberosum Vegetables
BXGF00810 Cereals and cereal products Cereals and cereal products
BXGF00820 Mollusks Aquatic foods
BXGF00823 Fruits 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