Showing entry for (E)-2-Hexenoic acid


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0004167
Compound Name(E)-2-Hexenoic acid
Structure
FormulaC6H10O2
InchiKeyNIONDZDPPYHYKY-SNAWJCMRSA-N
SMILESCCC\C=C\C(O)=O
InchiInChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h4-5H,2-3H2,1H3,(H,7,8)/b5-4+
IUPAC(2E)-hex-2-enoic acid
Molecular Weight114.14
Pubchem Id5282707
Chembl IdCHEMBL2252747
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 CHEMBL2252747
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
O42275 BXGT004559 Acetylcholinesterase reviewed - ache Inhibition '=' 14 %
P81908 BXGT011959 Cholinesterase reviewed - BCHE Inhibition '=' 5 %
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00017 Burdock Arctium lappa Vegetables
BXGF00038 Tea Camellia sinensis Teas
BXGF00204 Common grape Vitis vinifera Fruits
BXGF00806 Alcoholic beverages Beverages
BXGF00808 Pomes Fruits
BXGF00816 Fats and oils Fats and oils
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