Showing entry for Veraguensin



                             
General Compound Information
BXGC IdBXGC0022410
Compound NameVeraguensin
Structure
FormulaC22H28O5
InchiKeyJLJAVUZBHSLLJL-SRLQQUAWSA-N
SMILESCOc1cc(ccc1OC)[C@@H]1O[C@@H]([C@@H]([C@H]1C)C)c1ccc(c(c1)OC)OC
InchiInChI=1S/C22H28O5/c1-13-14(2)22(16-8-10-18(24-4)20(12-16)26-6)27-21(13)15-7-9-17(23-3)19(11-15)25-5/h7-14,21-22H,1-6H3/t13-,14-,21-,22+/m1/s1
IUPAC(2S,3R,4R,5R)-2,5-bis(3,4-dimethoxyphenyl)-3,4-dimethyloxolane
Molecular Weight372.19
Pubchem Id44340797
Chembl IdCHEMBL112481
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 50002830
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 BXGT008663 Platelet-activating factor receptor reviewed PTAFR - 1000 - -
reviewed BXGT009021 Platelet-activating factor receptor reviewed G-protein coupled receptor PTAFR 1000 - - -
CHEMBL CHEMBL112481
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
P25105 BXGT009021 Platelet-activating factor receptor reviewed G-protein coupled receptor PTAFR Ki '=' 1000 nM
P21556 BXGT008663 Platelet-activating factor receptor reviewed - PTAFR IC50 '=' 1000 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF01284 Saururus cernuus Saururus cernuus Medicinal Plant
BXGF01687 Magnolia liliiflora Magnolia liliiflora Others
BXGF01958 Magnolia denudata Magnolia denudata Medicinal Plant
BXGF02457 Magnolia acuminata Magnolia acuminata Medicinal Plant
BXGF04970 Magnolia liliflora Magnolia liliflora Medicinal Plant
BXGF05353 Piper kadsura Piper kadsura Others
BXGF05511 Acorus gramineus Acorus gramineus Medicinal Plant
BXGF06071 Acorus tatarinowii Acorus tatarinowii 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