Showing entry for Kaempferol 3-robinobioside


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0008943
Compound NameKaempferol 3-robinobioside
Structure
FormulaC27H30O15
InchiKeyRTATXGUCZHCSNG-UHFFFAOYSA-N
SMILESCC1OC(OCC2OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC=C(O)C=C3)C(O)C(O)C2O)C(O)C(O)C1O
InchiInChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3
IUPAC5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-4H-chromen-4-one
Molecular Weight594.52
Pubchem Id12313332
Chembl IdCHEMBL1419228
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 CHEMBL1419228
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
Q9UBT6 BXGT021664 DNA polymerase kappa reviewed - POLK Potency - 28183 nM
Q9UNA4 BXGT021785 DNA polymerase iota reviewed - POLI Potency - 42284 nM
Q14191 BXGT013452 Werner syndrome ATP-dependent helicase reviewed Enzyme WRN Potency - 79432 nM
P03070 BXGT006016 Large T antigen reviewed - IC50 - 17260 nM
O94925 BXGT005342 Glutaminase kidney isoform, mitochondrial reviewed Enzyme GLS Potency - 11220 nM
P46063 BXGT010501 ATP-dependent DNA helicase Q1 reviewed Enzyme RECQL Potency '=' 39810 nM
P07378 BXGT006616 Phosphoglycerate kinase, glycosomal reviewed - Potency - 22387 nM
Q9Y253 BXGT022216 DNA polymerase eta reviewed - POLH Potency - 60119 nM
Q13526 BXGT013369 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 reviewed - PIN1 Potency - 44668 nM
Q9NR56 BXGT021179 Muscleblind-like protein 1 reviewed Nucleic acid binding MBNL1 Potency - 14125 nM
P27695 BXGT009199 DNA-(apurinic or apyrimidinic site) lyase reviewed - APEX1 Potency '=' 3162 nM
P10253 BXGT007550 Lysosomal alpha-glucosidase reviewed Enzyme GAA Potency '=' 31622 nM
Q9UNA4 BXGT021785 DNA polymerase iota reviewed - POLI Potency - 44668 nM
Q9Y468 BXGT022270 Lethal(3)malignant brain tumor-like protein 1 reviewed Epigenetic regulator L3MBTL1 Potency '=' 14125 nM
Q13951 BXGT013407 Core-binding factor subunit beta reviewed - CBFB Potency - 19952 nM
Q01196 BXGT012575 Runt-related transcription factor 1 reviewed Transcription factor RUNX1 Potency - 19952 nM
P06746 BXGT006496 DNA polymerase beta reviewed Enzyme POLB Potency '=' 3981 nM
P04608 BXGT006236 Protein Tat reviewed - tat IC50 '>' 100000 nM
Q99700 BXGT019949 Ataxin-2 reviewed Nucleic acid binding ATXN2 Potency - 22387 nM
O75164 BXGT005104 Lysine-specific demethylase 4A reviewed - KDM4A Potency - 56234 nM
P27695 BXGT009199 DNA-(apurinic or apyrimidinic site) lyase reviewed - APEX1 Potency - 3548 nM
P39748 BXGT010134 Flap endonuclease 1 reviewed Enzyme FEN1 Potency - 44668 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 366 nM
Q9Y253 BXGT022216 DNA polymerase eta reviewed - POLH Potency - 10000 nM
Q9UIF8 BXGT021718 Bromodomain adjacent to zinc finger domain protein 2B reviewed - BAZ2B Potency - 70794 nM
Q4GZG4 BXGT014813 Phosphoglycerate kinase unreviewed - PGKC Potency - 5168 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00004 Kiwi Actinidia chinensis Fruits
BXGF00038 Tea Camellia sinensis Teas
BXGF00039 Capers Capparis spinosa Herbs and Spices
BXGF00042 Safflower Carthamus tinctorius Herbs and Spices
BXGF00063 Saffron Crocus sativus Herbs and Spices
BXGF00081 Fig Ficus carica Fruits
BXGF00082 Fennel Foeniculum vulgare Herbs and Spices
BXGF00085 Soy bean Glycine max Soy
BXGF00090 Star anise Illicium verum Herbs and Spices
BXGF00097 Sweet bay Laurus nobilis Herbs and Spices
BXGF00119 Sweet basil Ocimum basilicum Herbs and Spices
BXGF00134 Common bean Phaseolus vulgaris Pulses
BXGF00144 Apricot Prunus armeniaca Fruits
BXGF00148 Almond Prunus dulcis Nuts
BXGF00152 Pear Pyrus communis Fruits
BXGF00155 Blackcurrant Ribes nigrum Fruits
BXGF00183 Common thyme Thymus vulgaris Herbs and Spices
BXGF00315 Cottonseed Gossypium Herbs and Spices
BXGF00337 Ginkgo nuts Ginkgo biloba Herbs and Spices
BXGF00818 Herbs and Spices Herbs and Spices
BXGF00819 Pulses Pulses
BXGF00835 Green bean Phaseolus vulgaris Pulses
BXGF01147 Chelidonium majus Chelidonium majus Medicinal Plant
BXGF01506 Thymus quinquecostatus Thymus quinquecostatus Medicinal Plant
BXGF01721 Humulus lupulus Humulus lupulus Medicinal Plant
BXGF01868 Vitex negundo Vitex negundo Medicinal Plant
BXGF01973 Lonicera japonica Lonicera japonica Medicinal Plant
BXGF01991 Rosa rugosa Rosa rugosa Medicinal Plant
BXGF02567 Lycium chinense Lycium chinense Medicinal Plant
BXGF03100 Astragalus complanatus Astragalus complanatus Medicinal Plant
BXGF03152 Sophora japonica Sophora japonica Medicinal Plant
BXGF03645 Lycium barbarum Lycium barbarum Medicinal Plant
BXGF04283 Terminalia chebula Terminalia chebula Medicinal Plant
BXGF04607 Morus alba Morus alba Medicinal Plant
BXGF05204 Erigeron breviscapus Erigeron breviscapus Medicinal Plant
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