Showing entry for (+)-Chicoricacid


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0042451
Compound Name(+)-Chicoricacid
Structure
FormulaC22H18O12
InchiKeyYDDGKXBLOXEEMN-XAKUNQSDSA-N
SMILESO=C(O[C@H]([C@@H](C(=O)O)OC(=O)/C=C/c1ccc(c(c1)O)O)C(=O)O)/C=C/c1ccc(c(c1)O)O
InchiInChI=1S/C22H18O12/c23-13-5-1-11(9-15(13)25)3-7-17(27)33-19(21(29)30)20(22(31)32)34-18(28)8-4-12-2-6-14(24)16(26)10-12/h1-10,19-20,23-26H,(H,29,30)(H,31,32)/b7-3+,8-4+/t19-,20+
IUPAC(2R,3S)-2,3-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]butanedioic acid
Molecular Weight474.08
Pubchem Id6450976
Chembl IdCHEMBL397730
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 CHEMBL397730
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
Q76353 BXGT016849 Integrase unreviewed - IC50 '=' 15700 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00049 Chicory Cichorium intybus Vegetables
BXGF00181 Dandelion Taraxacum officinale Herbs and Spices
BXGF01545 Balanophora harlandii Balanophora harlandii Others
BXGF01668 Taraxacum platycarpum Taraxacum platycarpum Medicinal Plant
BXGF02152 Taraxacum borealisinense Taraxacum borealisinense Others
BXGF02377 Cichorium glandulosum Cichorium glandulosum Others
BXGF02493 Polemonium caeruleum Polemonium caeruleum Medicinal Plant
BXGF03307 Strychnos ledermannii Strychnos ledermannii Others
BXGF03630 Taraxacum coreanum Taraxacum coreanum Others
BXGF03838 Euphorbia biglandulosa Euphorbia biglandulosa Others
BXGF04219 Annona cherimolia Annona cherimolia Medicinal Plant
BXGF04310 Taraxacum mongolicum Taraxacum mongolicum Medicinal Plant
BXGF04698 Isodon rubescens Isodon rubescens Others
BXGF04902 Lupinus cosentinii Lupinus cosentinii Others
BXGF04983 Pulsatilla koreana Pulsatilla koreana Others
BXGF05359 Viburnum davidii Viburnum davidii Others
BXGF05400 Agathosma scaberula Agathosma scaberula Others
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