Showing entry for Methyl acetate


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0004193
Compound NameMethyl acetate
Structure
FormulaC3H6O2
InchiKeyKXKVLQRXCPHEJC-UHFFFAOYSA-N
SMILESCOC(C)=O
InchiInChI=1S/C3H6O2/c1-3(4)5-2/h1-2H3
IUPACmethyl acetate
Molecular Weight74.08
Pubchem Id6584
Chembl IdCHEMBL14079
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 CHEMBL14079
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
P00352 BXGT005510 Retinal dehydrogenase 1 reviewed Enzyme ALDH1A1 Potency '=' 70 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
BXGF00041 Papaya Carica papaya Fruits
BXGF00081 Fig Ficus carica Fruits
BXGF00086 Sunflower Helianthus annuus Herbs and Spices
BXGF00105 Apple Malus pumila Fruits
BXGF00110 Orange mint Mentha aquatica Herbs and Spices
BXGF00149 Peach Prunus persica Fruits
BXGF00206 Ginger Zingiber officinale Herbs and Spices
BXGF00823 Fruits Fruits
BXGF01185 Aloe vera Aloe vera Medicinal Plant
BXGF01900 Aloe ferox Aloe ferox Medicinal Plant
BXGF02425 Ephedra herba Ephedra herba Others
BXGF02635 Ephedra sinica Ephedra sinica Medicinal Plant
BXGF04605 Senna alexandrina Senna alexandrina Medicinal Plant
BXGF04631 Aloe spicata Aloe spicata Medicinal Plant
BXGF04705 Abrus precatorius Abrus precatorius Medicinal Plant
BXGF04889 Pogostemon cablin Pogostemon cablin Medicinal Plant
BXGF04926 Aloe africana Aloe africana Medicinal Plant
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