Showing entry for Vitexin 6''-O-malonyl 2''-O-xyloside



                             
General Compound Information
BXGC IdBXGC0001166
Compound NameVitexin 6''-O-malonyl 2''-O-xyloside
Structure
FormulaC21H20O10
InchiKeySGEWCQFRYRRZDC-VPRICQMDSA-N
SMILESOC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)C1=C2OC(=CC(=O)C2=C(O)C=C1O)C1=CC=C(O)C=C1
InchiInChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1
IUPAC5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-4H-chromen-4-one
Molecular Weight432.38
Pubchem Id5280441
Chembl IdCHEMBL487417
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 50362886
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 BXGT008083 Aldo-keto reductase family 1 member B1 reviewed Enzyme AKR1B1 - 566660 - -
CHEMBL CHEMBL487417
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
Q13951 BXGT013407 Core-binding factor subunit beta reviewed - CBFB Potency - 17782 nM
Q01196 BXGT012575 Runt-related transcription factor 1 reviewed Transcription factor RUNX1 Potency - 17782 nM
P81908 BXGT011959 Cholinesterase reviewed - BCHE Inhibition '=' 2 %
O42275 BXGT004559 Acetylcholinesterase reviewed - ache Inhibition '=' 3 %
B4URF0 BXGT002146 Neuraminidase unreviewed - NA IC50 '=' 46500 nM
Q9UBT6 BXGT021664 DNA polymerase kappa reviewed - POLK Potency - 23778 nM
P27695 BXGT009199 DNA-(apurinic or apyrimidinic site) lyase reviewed - APEX1 Potency - 8912 nM
B4URF0 BXGT002146 Neuraminidase unreviewed - NA IC50 '=' 49600 nM
P15121 BXGT008083 Aldo-keto reductase family 1 member B1 reviewed Enzyme AKR1B1 IC50 '=' 566660 nM
P80457 BXGT011911 Xanthine dehydrogenase/oxidase reviewed - XDH Inhibition '=' 0 %
B4URF0 BXGT002146 Neuraminidase unreviewed - NA IC50 '=' 45100 nM
O60218 BXGT004858 Aldo-keto reductase family 1 member B10 reviewed Enzyme AKR1B10 Inhibition - - -
O42713 BXGT004563 Polyphenol oxidase 2 reviewed - PPO2 IC50 - - -
P25099 BXGT009016 Adenosine receptor A1 reviewed - Adora1 Activity '=' 103 %
P03468 BXGT006079 Neuraminidase reviewed - NA logIC50 '=' 1 -
P03468 BXGT006079 Neuraminidase reviewed - NA IC50 '=' 20 ug.mL-1
P07943 BXGT006700 Aldo-keto reductase family 1 member B1 reviewed - Akr1b1 IC50 '=' 2030 nM
O42713 BXGT004563 Polyphenol oxidase 2 reviewed - PPO2 Inhibition - - -
P04798 BXGT006265 Cytochrome P450 1A1 reviewed Enzyme CYP1A1 Inhibition '=' 42 %
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00025 Common beet Beta vulgaris Vegetables
BXGF00142 Purslane Portulaca oleracea Herbs and Spices
BXGF00186 Fenugreek Trigonella foenum-graecum Herbs and Spices
BXGF00198 Adzuki bean Vigna angularis Pulses
BXGF00200 Mung bean Vigna radiata Pulses
BXGF00201 Climbing bean Vigna umbellata Pulses
BXGF00369 Sacred lotus Nelumbo nucifera Vegetables
BXGF00897 Afrocarpus falcatus Afrocarpus falcatus Medicinal Plant
BXGF00948 Artemisia apiacea Artemisia apiacea Medicinal Plant
BXGF01196 Elaeagnus commutata Elaeagnus commutata Medicinal Plant
BXGF01228 Ageratina adenophora Ageratina adenophora Medicinal Plant
BXGF01263 Adenopeltis colliguaya Adenopeltis colliguaya Others
BXGF01279 Coleostephus myconis Coleostephus myconis Medicinal Plant
BXGF01283 Crataegus pinnatifida Crataegus pinnatifida Medicinal Plant
BXGF01338 Amsinckia menziesii Amsinckia menziesii Others
BXGF01372 Quercus mongolica Quercus mongolica Medicinal Plant
BXGF01380 Cneorum pulverulentum Cneorum pulverulentum Medicinal Plant
BXGF01446 Perityle vaseyi Perityle vaseyi Others
BXGF01468 Ajuga australis Ajuga australis Medicinal Plant
BXGF01505 Gynostemma pentaphyllum Gynostemma pentaphyllum Medicinal Plant
BXGF01530 Lophatherum gracile Lophatherum gracile Medicinal Plant
BXGF01566 Pedicularis condensata Pedicularis condensata Others
BXGF01605 Palafoxia rosea Palafoxia rosea Others
BXGF01612 Elaeagnus pungens Elaeagnus pungens Medicinal Plant
BXGF01643 Chrozophora obliqua Chrozophora obliqua Medicinal Plant
BXGF01717 Senecio flavus Senecio flavus Medicinal Plant
BXGF01749 Salvia coulteri Salvia coulteri Others
BXGF01762 Persea kusanoi Persea kusanoi Others
BXGF01798 Melaleuca uncinata Melaleuca uncinata Others
BXGF01823 Houttuynia cordata Houttuynia cordata Medicinal Plant
BXGF01833 Hakea saligna Hakea saligna Others
BXGF01841 Cedronella canariensis Cedronella canariensis Medicinal Plant
BXGF01855 Porella swartziana Porella swartziana Others
BXGF01868 Vitex negundo Vitex negundo Medicinal Plant
BXGF01948 Meconopsis napaulensis Meconopsis napaulensis Medicinal Plant
BXGF01968 Rheum webbianum Rheum webbianum Medicinal Plant
BXGF01999 Mascarenhasia arborescens Mascarenhasia arborescens Others
BXGF02018 Solanum americanum Solanum americanum Medicinal Plant
BXGF02029 Eucalyptus flocktoniae Eucalyptus flocktoniae Others
BXGF02057 Kummerowia striata Kummerowia striata Medicinal Plant
BXGF02112 Thymbra spicata Thymbra spicata Medicinal Plant
BXGF02121 Humata pectinata Humata pectinata Others
BXGF02131 Glycyrrhiza Glycyrrhiza Medicinal Plant
BXGF02135 Phoebe formosana Phoebe formosana Others
BXGF02153 Sida cordifolia Sida cordifolia Medicinal Plant
BXGF02251 Pyrrosia lingua Pyrrosia lingua Medicinal Plant
BXGF02258 Millettia conraui Millettia conraui Medicinal Plant
BXGF02262 Pyrrosia tricuspis Pyrrosia tricuspis Others
BXGF02276 Synotis alata Synotis alata Others
BXGF02278 Centaurea seridis Centaurea seridis Others
BXGF02309 Flindersia brayleyana Flindersia brayleyana Others
BXGF02310 Craibiodendron henryi Craibiodendron henryi Others
BXGF02335 Satureja cuneifolia Satureja cuneifolia Human Edible Plant
BXGF02358 Consolida ajacis Consolida ajacis Medicinal Plant
BXGF02371 Justicia ciliata Justicia ciliata Others
BXGF02526 Santalum album Santalum album Medicinal Plant
BXGF02553 Avrainvillea nigricans Avrainvillea nigricans Others
BXGF02604 Agrimonia pilosa Agrimonia pilosa Medicinal Plant
BXGF02623 Physalis edulis Physalis edulis Others
BXGF02639 Rhododendron ferrugineum Rhododendron ferrugineum Human Edible Plant
BXGF02642 Vigna umbeuata Vigna umbeuata Others
BXGF02669 Canella winterana Canella winterana Medicinal Plant
BXGF02675 Salacia elliptica Salacia elliptica Human Edible Plant
BXGF02698 Crataegus tanacetifolia Crataegus tanacetifolia Medicinal Plant
BXGF02713 Drypetes roxburghii Drypetes roxburghii Medicinal Plant
BXGF02748 Pinus mugo Pinus mugo Medicinal Plant
BXGF02761 Croton cascarilloides Croton cascarilloides Medicinal Plant
BXGF02825 Buddleja variabilis Buddleja variabilis Others
BXGF02841 Gleditsia caspica Gleditsia caspica Medicinal Plant
BXGF02937 Senecio scandens Senecio scandens Medicinal Plant
BXGF03001 Vallaris solanacea Vallaris solanacea Medicinal Plant
BXGF03003 Flemingia chappar Flemingia chappar Medicinal Plant
BXGF03063 Gentiana straminea Gentiana straminea Medicinal Plant
BXGF03065 Mentha pulegiformis Mentha pulegiformis Others
BXGF03089 Cephalaria ambrosioides Cephalaria ambrosioides Others
BXGF03096 Salvia nubicola Salvia nubicola Human Edible Plant
BXGF03125 Grindelia nana Grindelia nana Others
BXGF03170 Haloxylon salicornicum Haloxylon salicornicum Medicinal Plant
BXGF03229 Leucanthemum maximum Leucanthemum maximum Others
BXGF03241 Boronia ternata Boronia ternata Others
BXGF03249 Vitex trifolia Vitex trifolia Medicinal Plant
BXGF03274 Buxus hyrcana Buxus hyrcana Medicinal Plant
BXGF03281 Calea megacephala Calea megacephala Others
BXGF03304 Sporobolus cynosuroides Sporobolus cynosuroides Others
BXGF03318 Capsicum tetragonum Capsicum tetragonum Others
BXGF03323 Abies nobilis Abies nobilis Others
BXGF03345 Persea indica Persea indica Medicinal Plant
BXGF03369 Corydalis cornuta Corydalis cornuta Others
BXGF03401 Disepalum plagioneurum Disepalum plagioneurum Others
BXGF03418 Piper aequale Piper aequale Medicinal Plant
BXGF03430 Alkanna hirsutissima Alkanna hirsutissima Others
BXGF03448 Pinus picea Pinus picea Others
BXGF03466 Picris radicata Picris radicata Others
BXGF03500 Croton megistocarpus Croton megistocarpus Others
BXGF03516 Gentiana macrophylla Gentiana macrophylla Medicinal Plant
BXGF03525 Acrocomia sclerocarpa Acrocomia sclerocarpa Others
BXGF03540 Eremophila serrulata Eremophila serrulata Others
BXGF03544 Nicotiana debneyi Nicotiana debneyi Others
BXGF03550 Rodgersia podophylla Rodgersia podophylla Medicinal Plant
BXGF03566 Delphinium campylocentrum Delphinium campylocentrum Others
BXGF03574 Cordyline indivisa Cordyline indivisa Medicinal Plant
BXGF03588 Primula hirsuta Primula hirsuta Others
BXGF03604 Jasminum grandiflorum Jasminum grandiflorum Medicinal Plant
BXGF03611 Viscum coloratum Viscum coloratum Medicinal Plant
BXGF03618 Marrubium vulgare Marrubium vulgare Medicinal Plant
BXGF03623 Heracleum sphondylium Heracleum sphondylium Medicinal Plant
BXGF03627 Strychnos camptoneura Strychnos camptoneura Others
BXGF03652 Cinnamomum kotoense Cinnamomum kotoense Others
BXGF03653 Abies veitchii Abies veitchii Others
BXGF03660 Microcos paniculata Microcos paniculata Medicinal Plant
BXGF03666 Bituminaria bituminosa Bituminaria bituminosa Medicinal Plant
BXGF03669 Clausena lansium Clausena lansium Medicinal Plant
BXGF03674 Zanthoxylum ailanthoides Zanthoxylum ailanthoides Medicinal Plant
BXGF03690 Narcissus obesus Narcissus obesus Others
BXGF03697 Epidendrum rigidum Epidendrum rigidum Others
BXGF03705 Ainsliaea macrocephala Ainsliaea macrocephala Others
BXGF03713 Trollius macropetalus Trollius macropetalus Others
BXGF03721 Lysimachia christinae Lysimachia christinae Medicinal Plant
BXGF03722 Dicoma anomala Dicoma anomala Medicinal Plant
BXGF03730 Cytisus ratisbonensis Cytisus ratisbonensis Others
BXGF03738 Luculia pinceana Luculia pinceana Others
BXGF03762 Pyrrosia petiolosa Pyrrosia petiolosa Medicinal Plant
BXGF03787 Vellozia nivea Vellozia nivea Others
BXGF03796 Buxus microphylla Buxus microphylla Medicinal Plant
BXGF03823 Thalictrum cultratum Thalictrum cultratum Medicinal Plant
BXGF03827 Pityrogramma ebenea Pityrogramma ebenea Others
BXGF03837 Casearia membranacea Casearia membranacea Medicinal Plant
BXGF03842 Turricula parryi Turricula parryi Others
BXGF03862 Sophora exigua Sophora exigua Others
BXGF03881 Acacia pycnantha Acacia pycnantha Medicinal Plant
BXGF03922 Galeopsis tetrahit Galeopsis tetrahit Medicinal Plant
BXGF03929 Conospermum teretifolium Conospermum teretifolium Others
BXGF03934 Lycoris traubii Lycoris traubii Others
BXGF03938 Nepeta cataria Nepeta cataria Medicinal Plant
BXGF03952 Ericameria diffusa Ericameria diffusa Others
BXGF04007 Bistorta vivipara Bistorta vivipara Medicinal Plant
BXGF04032 Ocotea pulchella Ocotea pulchella Others
BXGF04040 Uncaria laevigata Uncaria laevigata Medicinal Plant
BXGF04047 Spirodela polyrhiza Spirodela polyrhiza Others
BXGF04080 Persicaria orientalis Persicaria orientalis Medicinal Plant
BXGF04093 Lippia mexicana Lippia mexicana Human Edible Plant
BXGF04139 Carlina acaulis Carlina acaulis Medicinal Plant
BXGF04140 Dalbergia stipulacea Dalbergia stipulacea Medicinal Plant
BXGF04145 Salvia digitaloides Salvia digitaloides Medicinal Plant
BXGF04154 Eumorphia sericea Eumorphia sericea Others
BXGF04162 Asterogyne martiana Asterogyne martiana Others
BXGF04181 Eupatorium birmanicum Eupatorium birmanicum Medicinal Plant
BXGF04206 Cirsium tanakae Cirsium tanakae Human Edible Plant
BXGF04230 Sigesbeckia pubescens Sigesbeckia pubescens Others
BXGF04246 Chrysosplenium echinus Chrysosplenium echinus Others
BXGF04253 Eriostemon thryptomenoides Eriostemon thryptomenoides Others
BXGF04271 Artemisia annua Artemisia annua Medicinal Plant
BXGF04282 Beilschmiedia volckii Beilschmiedia volckii Others
BXGF04290 Garcinia pseudoguttifera Garcinia pseudoguttifera Medicinal Plant
BXGF04305 Heliotropium eichwaldii Heliotropium eichwaldii Medicinal Plant
BXGF04311 Berkheya zeyheri Berkheya zeyheri Human Edible Plant
BXGF04314 Xanthium pungens Xanthium pungens Others
BXGF04320 Ligularia lamarum Ligularia lamarum Others
BXGF04322 Baccharis magellanica Baccharis magellanica Others
BXGF04329 Swertia swertopsis Swertia swertopsis Others
BXGF04337 Premna tomentosa Premna tomentosa Medicinal Plant
BXGF04339 Thermopsis alpina Thermopsis alpina Medicinal Plant
BXGF04348 Sagittaria sagittifolia Sagittaria sagittifolia Medicinal Plant
BXGF04350 Lygodium flexuosum Lygodium flexuosum Medicinal Plant
BXGF04352 Aloe vulgaris Aloe vulgaris Human Edible Plant
BXGF04357 Gentiana dahurica Gentiana dahurica Medicinal Plant
BXGF04359 Cunonia macrophylla Cunonia macrophylla Medicinal Plant
BXGF04367 Tsuga chinensis Tsuga chinensis Medicinal Plant
BXGF04369 Taxus brevifolia Taxus brevifolia Medicinal Plant
BXGF04373 Virgilia divaricata Virgilia divaricata Others
BXGF04378 Entada rheedei Entada rheedei Medicinal Plant
BXGF04389 Humulus japonicus Humulus japonicus Medicinal Plant
BXGF04394 Aucuba chinensis Aucuba chinensis Others
BXGF04398 Utricularia australis Utricularia australis Others
BXGF04403 Amsinckia tessellata Amsinckia tessellata Others
BXGF04404 Carica dodecaphylla Carica dodecaphylla Others
BXGF04406 Citrus tangerina Citrus tangerina Human Edible Plant
BXGF04411 Crocus minimus Crocus minimus Human Edible Plant
BXGF04414 Curculigo pilosa Curculigo pilosa Medicinal Plant
BXGF04416 Sideritis euboea Sideritis euboea Others
BXGF04423 Osteospermum muricatum Osteospermum muricatum Others
BXGF04425 Centaurea huber-morathii Centaurea huber-morathii Others
BXGF04429 Sisyrinchium californicum Sisyrinchium californicum Others
BXGF04432 Saussurea amara Saussurea amara Others
BXGF04439 Lysiana subfalcata Lysiana subfalcata Human Edible Plant
BXGF04441 Haplophyllum ramosissimum Haplophyllum ramosissimum Others
BXGF04446 Peperomia vulcanica Peperomia vulcanica Medicinal Plant
BXGF04456 Sorbus tianschanica Sorbus tianschanica Medicinal Plant
BXGF04463 Platycarya strobilacea Platycarya strobilacea Medicinal Plant
BXGF04474 Helichrysum mixtum Helichrysum mixtum Others
BXGF04478 Cynometra lujae Cynometra lujae Others
BXGF04482 Aspalathus linearis Aspalathus linearis Medicinal Plant
BXGF04486 Eupatorium areolare Eupatorium areolare Others
BXGF04492 Stephania elegans Stephania elegans Medicinal Plant
BXGF04709 Strychnos staudtii Strychnos staudtii Others
BXGF04727 Dictyoloma incanescens Dictyoloma incanescens Others
BXGF04738 Saccharum spontaneum Saccharum spontaneum Medicinal Plant
BXGF04746 Crotalaria anagyroides Crotalaria anagyroides Medicinal Plant
BXGF04762 Gutierrezia microcephala Gutierrezia microcephala Others
BXGF04768 Sigesbeckia glabrescens Sigesbeckia glabrescens Medicinal Plant
BXGF04778 Dasymaschalon sootepense Dasymaschalon sootepense Others
BXGF04782 Croton poilanei Croton poilanei Others
BXGF04794 Tsuga mertensiana Tsuga mertensiana Medicinal Plant
BXGF04820 Panax ginseng Panax ginseng 0
BXGF04834 Guatteria melosma Guatteria melosma Others
BXGF04843 Brickellia vernicosa Brickellia vernicosa Others
BXGF04850 Macaranga peltata Macaranga peltata Medicinal Plant
BXGF04860 Securinega melanthesoides Securinega melanthesoides Others
BXGF04865 Euonymus sachalinensis Euonymus sachalinensis Medicinal Plant
BXGF04870 Felicia erigeroides Felicia erigeroides Others
BXGF04879 Lupinus paniculatus Lupinus paniculatus Others
BXGF04886 Boehmeria nivea Boehmeria nivea Medicinal Plant
BXGF05041 Desmodium styracifolium Desmodium styracifolium Medicinal Plant
BXGF05052 microtea debilis microtea debilis Others
BXGF05080 Jungermannia obovata Jungermannia obovata Others
BXGF05124 Gentiana crassicaulis Gentiana crassicaulis Medicinal Plant
BXGF05239 Dicranopteris linearis Dicranopteris linearis Medicinal Plant
BXGF05258 Geranium sibiricum Geranium sibiricum Medicinal Plant
BXGF05301 Baphicacanthus cusia Baphicacanthus cusia Medicinal Plant
BXGF05303 Lagerstroemia indica Lagerstroemia indica Medicinal Plant
BXGF05394 Turraeanthus mannii Turraeanthus mannii Others
BXGF05430 Coleus garckeanus Coleus garckeanus Others
BXGF05490 Solanum sisymbriifolium Solanum sisymbriifolium Medicinal Plant
BXGF05519 Gerbera piloselloides Gerbera piloselloides Medicinal Plant
BXGF05563 Phegopteris bukoensis Phegopteris bukoensis Others
BXGF05571 Ziziphus jujuba Ziziphus jujuba Medicinal Plant
BXGF05651 Humulus scandens Humulus scandens Human Edible Plant
BXGF05749 Kali turgidum Kali turgidum Medicinal Plant
BXGF05801 Colchicum robustum Colchicum robustum Others
BXGF05849 Salacia chinensis Salacia chinensis Medicinal Plant
BXGF05853 Cannabis sativa Cannabis sativa Medicinal Plant
BXGF05878 Senecio isatideus Senecio isatideus Others
BXGF05890 Sophora tonkinensis Sophora tonkinensis Others
BXGF05921 Scapania nemorea Scapania nemorea Others
BXGF06112 Daphne giraldii Daphne giraldii Others
BXGF06171 Dahlia pinnata Dahlia pinnata Medicinal Plant
BXGF06208 Rosa transmorrisonensis Rosa transmorrisonensis Others
BXGF06268 Zanthoxylum nitidum Zanthoxylum nitidum Medicinal Plant
BXGF06273 Parablechnum minus Parablechnum minus Others
BXGF06285 Merremia umbellata Merremia umbellata 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