Showing entry for Hexanal



                             
General Compound Information
BXGC IdBXGC0004157
Compound NameHexanal
Structure
FormulaC6H12O
InchiKeyJARKCYVAAOWBJS-UHFFFAOYSA-N
SMILESCCCCCC=O
InchiInChI=1S/C6H12O/c1-2-3-4-5-6-7/h6H,2-5H2,1H3
IUPAChexanal
Molecular Weight100.16
Pubchem Id6184
Chembl IdCHEMBL280331
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 O8Y
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
Q88N39 BXGT025201 3-oxoadipyl-CoA thiolase unreviewed pcaF-I - - - - -
Binding DB 50028824
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 BXGT007632 Phenylethanolamine N-methyltransferase reviewed PNMT - 314000 - -
CHEMBL CHEMBL280331
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
P10938 BXGT007632 Phenylethanolamine N-methyltransferase reviewed - PNMT IC50 '=' 314000 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00006 Garden onion Allium cepa Vegetables
BXGF00011 Cashew nut Anacardium occidentale Nuts
BXGF00015 Wild celery Apium graveolens Herbs and Spices
BXGF00022 Oat Avena sativa Cereals and cereal products
BXGF00027 Chinese mustard Brassica juncea Vegetables
BXGF00033 Kohlrabi Brassica oleracea var. gongylodes Vegetables
BXGF00038 Tea Camellia sinensis Teas
BXGF00040 Pepper (C. annuum) Capsicum annuum Vegetables
BXGF00041 Papaya Carica papaya Fruits
BXGF00042 Safflower Carthamus tinctorius Herbs and Spices
BXGF00050 Chinese cinnamon Cinnamomum aromaticum Herbs and Spices
BXGF00052 Watermelon Citrullus lanatus Gourds
BXGF00053 Lime Citrus aurantiifolia Fruits
BXGF00054 Lemon Citrus limon Fruits
BXGF00055 Pummelo Citrus maxima Fruits
BXGF00057 Sweet orange Citrus sinensis Fruits
BXGF00063 Saffron Crocus sativus Herbs and Spices
BXGF00065 Cucumber Cucumis sativus Gourds
BXGF00072 Wild carrot Daucus carota Vegetables
BXGF00077 Rocket salad (ssp.) Eruca vesicaria ssp. sativa Vegetables
BXGF00079 Common buckwheat Fagopyrum esculentum Cereals and cereal products
BXGF00082 Fennel Foeniculum vulgare Herbs and Spices
BXGF00085 Soy bean Glycine max Soy
BXGF00086 Sunflower Helianthus annuus Herbs and Spices
BXGF00093 Black walnut Juglans nigra Nuts
BXGF00097 Sweet bay Laurus nobilis Herbs and Spices
BXGF00105 Apple Malus pumila Fruits
BXGF00110 Orange mint Mentha aquatica Herbs and Spices
BXGF00111 Cornmint Mentha arvensis Herbs and Spices
BXGF00112 Spearmint Mentha spicata Herbs and Spices
BXGF00119 Sweet basil Ocimum basilicum Herbs and Spices
BXGF00121 Olive Olea europaea Vegetables
BXGF00124 Common oregano Origanum vulgare Herbs and Spices
BXGF00125 Rice Oryza sativa Cereals and cereal products
BXGF00131 Parsley Petroselinum crispum Herbs and Spices
BXGF00144 Apricot Prunus armeniaca Fruits
BXGF00149 Peach Prunus persica Fruits
BXGF00150 Guava Psidium guajava Fruits
BXGF00151 Pomegranate Punica granatum Fruits
BXGF00152 Pear Pyrus communis Fruits
BXGF00159 Rosemary Rosmarinus officinalis Herbs and Spices
BXGF00166 Black elderberry Sambucus nigra Fruits
BXGF00170 Sesame Sesamum orientale Herbs and Spices
BXGF00173 Garden tomato (var.) Solanum lycopersicum var. lycopersicum Vegetables
BXGF00175 Potato Solanum tuberosum Vegetables
BXGF00179 Cloves Syzygium aromaticum Herbs and Spices
BXGF00187 Common wheat Triticum aestivum Cereals and cereal products
BXGF00191 Highbush blueberry Vaccinium corymbosum Fruits
BXGF00194 Lingonberry Vaccinium vitis-idaea Fruits
BXGF00205 Corn Zea mays Cereals and cereal products
BXGF00206 Ginger Zingiber officinale Herbs and Spices
BXGF00380 White mustard Sinapis alba Herbs and Spices
BXGF00393 Pepper (C. frutescens) Capsicum annuum var. annuum Vegetables
BXGF00410 Roselle Hibiscus sabdariffa Herbs and Spices
BXGF00803 Cabbage Brassica oleracea var. capitata Vegetables
BXGF00829 Green bell pepper Capsicum annuum Vegetables
BXGF00830 Yellow bell pepper Capsicum annuum Vegetables
BXGF00831 Orange bell pepper Capsicum annuum Vegetables
BXGF00832 Red bell pepper Capsicum annuum Vegetables
BXGF00839 White cabbage Brassica oleracea L. var. capitata L. f. alba DC. Vegetables
BXGF00942 Odontites rubra Odontites rubra Others
BXGF00946 Artemisia montana Artemisia montana Medicinal Plant
BXGF01081 Akebia trifoliata Akebia trifoliata Medicinal Plant
BXGF01125 Schistostephium rotundifolium Schistostephium rotundifolium Others
BXGF01134 Arnebia euchroma Arnebia euchroma Medicinal Plant
BXGF01140 Angelica gigas Angelica gigas Medicinal Plant
BXGF01185 Aloe vera Aloe vera Medicinal Plant
BXGF01206 Prosopis ruscifolia Prosopis ruscifolia Medicinal Plant
BXGF01230 Lithospermum erythrorhizon Lithospermum erythrorhizon Medicinal Plant
BXGF01237 Magnolia obovata Magnolia obovata Medicinal Plant
BXGF01274 Garcinia macrophylla Garcinia macrophylla Medicinal Plant
BXGF01381 Siphocampylus verticillatus Siphocampylus verticillatus Others
BXGF01408 Flemingia prostrata roxb Flemingia prostrata roxb Others
BXGF01410 Viburnum chingii Viburnum chingii Others
BXGF01426 Cornus officinalis Cornus officinalis Medicinal Plant
BXGF01576 Maytenus loeseneri Maytenus loeseneri Others
BXGF01689 Aconitum kamtschaticum Aconitum kamtschaticum Others
BXGF01716 Mentha canadensis Mentha canadensis Medicinal Plant
BXGF01721 Humulus lupulus Humulus lupulus Medicinal Plant
BXGF01766 Maytenus serrata Maytenus serrata Medicinal Plant
BXGF01870 Dipteronia dyeriana Dipteronia dyeriana Others
BXGF01878 Lobelia chinensis Lobelia chinensis Medicinal Plant
BXGF01900 Aloe ferox Aloe ferox Medicinal Plant
BXGF01911 Bupleurum scorzonerifolium Bupleurum scorzonerifolium Medicinal Plant
BXGF01973 Lonicera japonica Lonicera japonica Medicinal Plant
BXGF01976 Podocarpus salignus Podocarpus salignus Medicinal Plant
BXGF01981 Psychotria bahiensis Psychotria bahiensis Others
BXGF02024 Actaea dahurica Actaea dahurica Human Edible Plant
BXGF02049 Angelica sinensis Angelica sinensis Medicinal Plant
BXGF02052 Oldenlandia diffusa Oldenlandia diffusa Medicinal Plant
BXGF02069 Plectranthus mollis Plectranthus mollis Medicinal Plant
BXGF02142 Dodonaea polyandra Dodonaea polyandra Medicinal Plant
BXGF02143 Actaea cimicifuga Actaea cimicifuga Medicinal Plant
BXGF02167 Scutellaria barbata Scutellaria barbata Medicinal Plant
BXGF02182 Atractylodes lancea Atractylodes lancea Medicinal Plant
BXGF02192 Actinidia kolomikta Actinidia kolomikta Medicinal Plant
BXGF02236 Murraya kwangsiensis Murraya kwangsiensis Medicinal Plant
BXGF02281 Veratrum stenophyllum Veratrum stenophyllum Others
BXGF02299 Phalaenopsis aphrodite Phalaenopsis aphrodite Others
BXGF02422 Sideritis syriaca Sideritis syriaca Medicinal Plant
BXGF02425 Ephedra herba Ephedra herba Others
BXGF02542 Inula helenium Inula helenium Medicinal Plant
BXGF02567 Lycium chinense Lycium chinense Medicinal Plant
BXGF02612 Mosla chinensis Mosla chinensis Medicinal Plant
BXGF02792 Ligusticum sinense Ligusticum sinense Medicinal Plant
BXGF02815 Pinellia ternata Pinellia ternata Medicinal Plant
BXGF02927 Akebia quinata Akebia quinata Medicinal Plant
BXGF02937 Senecio scandens Senecio scandens Medicinal Plant
BXGF03053 Arnebia guttata Arnebia guttata Medicinal Plant
BXGF03130 Panax quinquefolius Panax quinquefolius Medicinal Plant
BXGF03162 Atractylodes macrocephala Atractylodes macrocephala Medicinal Plant
BXGF03243 Elsholtzia ciliata Elsholtzia ciliata Medicinal Plant
BXGF03348 Panax notoginseng Panax notoginseng Medicinal Plant
BXGF03379 Cnidium officinale Cnidium officinale Medicinal Plant
BXGF03384 Vepris pilosa Vepris pilosa Others
BXGF03479 Bombax ceiba Bombax ceiba Medicinal Plant
BXGF03610 Bistorta officinalis Bistorta officinalis Medicinal Plant
BXGF03645 Lycium barbarum Lycium barbarum Medicinal Plant
BXGF03953 Artemisia princeps Artemisia princeps Medicinal Plant
BXGF04023 Putterlickia verrucosa Putterlickia verrucosa Others
BXGF04087 Erysimum odoratum Erysimum odoratum Others
BXGF04092 Heterotheca inuloides Heterotheca inuloides Medicinal Plant
BXGF04098 Delphinium andersoni Delphinium andersoni Others
BXGF04109 Saussurea costus Saussurea costus Medicinal Plant
BXGF04126 Vismia jefensis Vismia jefensis Others
BXGF04142 Angelica tarokoensis Angelica tarokoensis Others
BXGF04147 Swertia delavayi Swertia delavayi Others
BXGF04151 Ophiorrhiza blumeana Ophiorrhiza blumeana Others
BXGF04165 Epimedium davidii Epimedium davidii Medicinal Plant
BXGF04168 Globba malaccensis Globba malaccensis Medicinal Plant
BXGF04175 Diphasia angolensis Diphasia angolensis Others
BXGF04182 Knightia excelsa Knightia excelsa Medicinal Plant
BXGF04197 Zanthoxylum chiriquinum Zanthoxylum chiriquinum Others
BXGF04199 Isodon japonicus Isodon japonicus Medicinal Plant
BXGF04207 Solanum acaule Solanum acaule Others
BXGF04216 Frullania tamarisci Frullania tamarisci Others
BXGF04221 Alangium premnifolium Alangium premnifolium Others
BXGF04224 Bistorta manshuriensis Bistorta manshuriensis Others
BXGF04233 Saussurea carthamoides Saussurea carthamoides Others
BXGF04250 Galenia africana Galenia africana Medicinal Plant
BXGF04264 Micromeria pineolens Micromeria pineolens Others
BXGF04269 Gnidia lamprantha Gnidia lamprantha Medicinal Plant
BXGF04276 Ilex amara Ilex amara Others
BXGF04295 Leonurus glaucescens Leonurus glaucescens Medicinal Plant
BXGF04342 Salacia madagascariensis Salacia madagascariensis Human Edible Plant
BXGF04343 Maba buxifolia Maba buxifolia Medicinal Plant
BXGF04357 Gentiana dahurica Gentiana dahurica Medicinal Plant
BXGF04361 Cynomorium songaricum Cynomorium songaricum Medicinal Plant
BXGF04402 Actaea simplex Actaea simplex Others
BXGF04484 Cirsium brevistylum Cirsium brevistylum Medicinal Plant
BXGF04602 Platycladus orientalis Platycladus orientalis Medicinal Plant
BXGF04605 Senna alexandrina Senna alexandrina Medicinal Plant
BXGF04611 Artemisia argyi Artemisia argyi Medicinal Plant
BXGF04631 Aloe spicata Aloe spicata Medicinal Plant
BXGF04777 Quercus sessiliflora Quercus sessiliflora Others
BXGF04820 Panax ginseng Panax ginseng 0
BXGF04842 Angelica acutiloba Angelica acutiloba Medicinal Plant
BXGF04875 Bupleurum chinense Bupleurum chinense Medicinal Plant
BXGF04926 Aloe africana Aloe africana Medicinal Plant
BXGF04981 Bupleurum falcatum Bupleurum falcatum Medicinal Plant
BXGF04982 Ligusticum chuanxiong Ligusticum chuanxiong Medicinal Plant
BXGF05011 Artemisia capillaries Artemisia capillaries Others
BXGF05135 Ongokea klaineana Ongokea klaineana Others
BXGF05264 Magnolia officinalis Magnolia officinalis Medicinal Plant
BXGF05269 Hypericum perforatum Hypericum perforatum Medicinal Plant
BXGF05309 Calypogeia integristipula Calypogeia integristipula Others
BXGF05442 Zanthoxylum bungeanum Zanthoxylum bungeanum Medicinal Plant
BXGF05462 Campsis flos Campsis flos Others
BXGF05474 Gymnanthemum amygdalinum Gymnanthemum amygdalinum Medicinal Plant
BXGF05480 Lepidium draba Lepidium draba Medicinal Plant
BXGF05535 Desmodium oxyphyllum Desmodium oxyphyllum Others
BXGF05661 Aconitum vilmorinianum Aconitum vilmorinianum Others
BXGF05662 Vernonia condensata Vernonia condensata Others
BXGF05758 Boronella koniambiensis Boronella koniambiensis Others
BXGF05779 Canarium strictum Canarium strictum Medicinal Plant
BXGF05891 Peucedanum palustre Peucedanum palustre Medicinal Plant
BXGF05905 Coreopsis grandiflora Coreopsis grandiflora Garden Plant
BXGF05977 Schisandra chinensis Schisandra chinensis Medicinal Plant
BXGF06070 Perilla frutescens Perilla frutescens Medicinal Plant
BXGF06072 Physalis solanaceus Physalis solanaceus Others
BXGF06075 Zanthoxylum schinifolium Zanthoxylum schinifolium Medicinal Plant
BXGF06107 Glehnia littoralis Glehnia littoralis 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