Showing entry for (7R)-7-Hydroxylariciresinol



                             
General Compound Information
BXGC IdBXGC0050660
Compound Name(7R)-7-Hydroxylariciresinol
Structure
FormulaC20H24O7
InchiKeyMWQRAOGWLXTMIC-WZBLMQSHSA-N
SMILESOC[C@@H]1[C@H](OC[C@@H]1[C@H](c1ccc(c(c1)OC)O)O)c1ccc(c(c1)OC)O
InchiInChI=1S/C20H24O7/c1-25-17-7-11(3-5-15(17)22)19(24)14-10-27-20(13(14)9-21)12-4-6-16(23)18(8-12)26-2/h3-8,13-14,19-24H,9-10H2,1-2H3/t13-,14-,19-,20+/m0/s1
IUPAC4-[(2S,3R,4R)-4-[(R)-hydroxy-(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenol
Molecular Weight376.15
Pubchem Id10022393
Chembl IdCHEMBL1668112
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 50335918
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 BXGT006812 Cytochrome P450 3A4 reviewed Enzyme CYP3A4 - 66500 - -
reviewed BXGT007595 Cytochrome P450 2D6 reviewed CYP2D6 - >100000 - -
CHEMBL CHEMBL1668112
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
P10635 BXGT007595 Cytochrome P450 2D6 reviewed - CYP2D6 IC50 '>' 100000 nM
P08684 BXGT006812 Cytochrome P450 3A4 reviewed Enzyme CYP3A4 IC50 '=' 66500 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF02740 Anemone thalictroides Anemone thalictroides Medicinal Plant
BXGF03408 Tecoma undulata Tecoma undulata Others
BXGF03437 Alhagi maurorum Alhagi maurorum Medicinal Plant
BXGF03729 Pulicaria insignis Pulicaria insignis Others
BXGF03791 Pistacia chinensis Pistacia chinensis Medicinal Plant
BXGF03809 Lobelia inflata Lobelia inflata Medicinal Plant
BXGF03856 Goniothalamus dolichocarpus Goniothalamus dolichocarpus Others
BXGF03903 Helicia nilagirica Helicia nilagirica Human Edible Plant
BXGF03906 Erythrophleum chlorostachys Erythrophleum chlorostachys Others
BXGF03942 Phaleria macrocarpa Phaleria macrocarpa Medicinal Plant
BXGF04001 Guettarda platypoda Guettarda platypoda Others
BXGF04010 Sapium indicum Sapium indicum Medicinal Plant
BXGF04015 Allium angulosum Allium angulosum Medicinal Plant
BXGF04025 Desmodium pulchellu Desmodium pulchellu Others
BXGF04415 Vernonia brevifolia Vernonia brevifolia Others
BXGF04661 Achyrocline tomentosa Achyrocline tomentosa Medicinal Plant
BXGF04918 Taxus yunnanensis Taxus yunnanensis Others
BXGF05139 Achyranthes obtusifolia Achyranthes obtusifolia Medicinal Plant
BXGF05693 Picea jezoensis var. jezoensis Picea jezoensis var. jezoensis 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