Showing entry for Cudraflavanone D



                             
General Compound Information
BXGC IdBXGC0021537
Compound NameCudraflavanone D
Structure
FormulaC25H28O6
InchiKeyXLHAGJGNSIEVFB-QFIPXVFZSA-N
SMILESCC(=CCc1cc([C@@H]2CC(=O)c3c(O2)cc(c(c3O)CC=C(C)C)O)c(cc1O)O)C
InchiInChI=1S/C25H28O6/c1-13(2)5-7-15-9-17(19(27)10-18(15)26)22-12-21(29)24-23(31-22)11-20(28)16(25(24)30)8-6-14(3)4/h5-6,9-11,22,26-28,30H,7-8,12H2,1-4H3/t22-/m0/s1
IUPAC(2S)-2-[2,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
Molecular Weight424.19
Pubchem Id44419446
Chembl IdCHEMBL218741
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 50193723
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 BXGT005162 Sterol O-acyltransferase 2 reviewed Enzyme SOAT2 - 89600 - -
reviewed BXGT005592 Pancreatic triacylglycerol lipase reviewed PNLIP - 9000 - -
CHEMBL CHEMBL218741
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
P00591 BXGT005592 Pancreatic triacylglycerol lipase reviewed - PNLIP Inhibition '=' 74 %
O75908 BXGT005162 Sterol O-acyltransferase 2 reviewed Enzyme SOAT2 IC50 '=' 89600 nM
P35610 BXGT009855 Sterol O-acyltransferase 1 reviewed Enzyme SOAT1 Activity - - -
P00591 BXGT005592 Pancreatic triacylglycerol lipase reviewed - PNLIP IC50 '=' 9000 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF04967 Cudrania tricuspidata Cudrania tricuspidata 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