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Displaying natural products 1 - 25 of 41066 in total
NP-MRD ID
CAS Number
Compound Name Species of OriginChemical StructureChemical Formula
Average Mass
Monoisotopic Mass
NMR Spectra
Strychnine
  • Strychnos atlantica
  • Strychnos cinnamomifolia
  • Strychnos columbrina
  • Strychnos ignatii
  • Strychnos ligustrina
  • Strychnos lucida R.Br.
  • Strychnos nitida
  • Strychnos nux-vomica
  • Strychnos nux-vomica L.
  • Strychnos spinosa
  • Strychnos tieute
  • Strychnos triplinervia
  • (show allshow less)
ThumbC21H22N2O2

334.4116 Da
334.16813 Da
1H NMR Spectrum (1D, 400 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 50 MHz, CDCl3, experimental)
1H NMR Spectrum (1D, 400 MHz, CDCl3, simulated)
Cotinine
  • Nicotiana tabacum (L.)
ThumbC10H12N2O

176.2151 Da
176.09496 Da
1H NMR Spectrum (1D, 500 MHz, H2O, experimental)
1H NMR Spectrum (1D, 500 MHz, H2O, simulated)
1H NMR Spectrum (1D, 500 MHz, H2O, experimental)
1H NMR Spectrum (1D, 500 MHz, H2O, simulated)
1H NMR Spectrum (1D, 500 MHz, H2O, experimental)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, H2O, experimental)
Coumarin
  • Amburana cearensis
  • Artemisia annua
  • Asparagus officinalis
  • Cinnamomum burmannii Nees ex BI
  • Cinnamomum cassia
  • Cinnamomum loureirii
  • Dalea tuberculata
  • Daucus carota
  • Dipteryx odorata
  • Dipteryx punctata
  • Eupatorium odoratum
  • Ficus simplicissima
  • Ginkgo biloba
  • Hydrocotyle sibthorpioides
  • Hypericum japonicum
  • Impatiens siculifer
  • Liatris squarrosa
  • Picea abies
  • Scabiosa comosa
  • Tetrapanax papyriferus
  • Verbascum thapsus
  • (show allshow less)
ThumbC9H6O2

146.1450 Da
146.03678 Da
1H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
1H NMR Spectrum (1D, 400 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 400 MHz, CDCl3, experimental)
1H NMR Spectrum (1D, 400 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 400 MHz, CDCl3, experimental)
1H NMR Spectrum (1D, 400 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 400 MHz, CDCl3, experimental)
1H NMR Spectrum (1D, 400 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 400 MHz, CDCl3, experimental)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, CDCl3, experimental)
Anabasine
  • Alangium chinense
  • Alangium chinense var.pauciflorum.
  • Alangium kurzii
  • Alangium platanifolium
  • Alangium salviifolium
  • Anabasis aphylla
  • Cyphanthera spinescens
  • Duboisia myoporoides
  • Leontice albertii
  • Lupinus formosus
  • Nicotiana acaulis
  • Nicotiana acuminata
  • Nicotiana africana
  • Nicotiana alata
  • Nicotiana ameghinoi
  • Nicotiana amplexicaulis
  • Nicotiana arentsii
  • Nicotiana attenuata
  • Nicotiana benavidesii
  • Nicotiana benthamiana
  • Nicotiana bigelovii
  • Nicotiana bonariensis
  • Nicotiana cavicola
  • Nicotiana clevelandii
  • Nicotiana cordifolia
  • Nicotiana corymbosa
  • Nicotiana debneyi
  • Nicotiana excelsior
  • Nicotiana exigua
  • Nicotiana forgetiana
  • Nicotiana fragrans
  • Nicotiana glauca
  • Nicotiana glutinosa
  • Nicotiana goodspeedii
  • Nicotiana gossei
  • Nicotiana hesperis
  • Nicotiana ingulba
  • Nicotiana kawakamii
  • Nicotiana knightiana
  • Nicotiana langsdorffii
  • Nicotiana linearis
  • Nicotiana longibracteata
  • Nicotiana longiflora
  • Nicotiana maritima
  • Nicotiana megalosiphon
  • Nicotiana miersii
  • Nicotiana nesophila
  • Nicotiana noctiflora
  • Nicotiana nudicaulis
  • Nicotiana occidentalis
  • Nicotiana otophora
  • Nicotiana paniculata
  • Nicotiana pauciflora
  • Nicotiana petunioides
  • Nicotiana plumbaginifolia
  • Nicotiana raimondii
  • Nicotiana repanda
  • Nicotiana rosulata
  • Nicotiana rotundifolia
  • Nicotiana rustica
  • Nicotiana setchellii
  • Nicotiana simulans
  • Nicotiana solanifolia
  • Nicotiana spegazzinii
  • Nicotiana stocktonii
  • Nicotiana suaveolens
  • Nicotiana sylvestris
  • Nicotiana tabacum (L.)
  • Nicotiana thyrosiflora
  • Nicotiana tobacum
  • Nicotiana tomentosa
  • Nicotiana tomentosiformis
  • Nicotiana trigonophylla
  • Nicotiana undulata
  • Nicotiana velutina
  • Nicotiana wigandioides
  • Priestleya tomentosa
  • Spartidium saharae
  • Verbascum songoricum
  • Zinnia elegans
  • (show allshow less)
ThumbC10H14N2

162.2316 Da
162.11570 Da
1H NMR Spectrum (1D, 600 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 600 MHz, H2O, simulated)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, CD3OD, experimental)
Canthaxanthin
  • Anabaena flos-aquae
  • Arabidopsis thaliana
  • Corbicula japonica
  • Corbicula sandai
  • Solanum tuberosum
Data?1628564076C40H52O2

564.8540 Da
564.39673 Da
13C NMR Spectrum (1D, 25 MHz, D2O, predicted)
1H NMR Spectrum (1D, 100 MHz, D2O, predicted)
13C NMR Spectrum (1D, 252 MHz, D2O, predicted)
1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)
13C NMR Spectrum (1D, 50 MHz, D2O, predicted)
1H NMR Spectrum (1D, 200 MHz, D2O, predicted)
13C NMR Spectrum (1D, 75 MHz, D2O, predicted)
1H NMR Spectrum (1D, 300 MHz, D2O, predicted)
13C NMR Spectrum (1D, 101 MHz, D2O, predicted)
1H NMR Spectrum (1D, 400 MHz, D2O, predicted)
13C NMR Spectrum (1D, 126 MHz, D2O, predicted)
1H NMR Spectrum (1D, 500 MHz, D2O, predicted)
13C NMR Spectrum (1D, 151 MHz, D2O, predicted)
1H NMR Spectrum (1D, 600 MHz, D2O, predicted)
13C NMR Spectrum (1D, 176 MHz, D2O, predicted)
1H NMR Spectrum (1D, 700 MHz, D2O, predicted)
13C NMR Spectrum (1D, 201 MHz, D2O, predicted)
1H NMR Spectrum (1D, 800 MHz, D2O, predicted)
13C NMR Spectrum (1D, 226 MHz, D2O, predicted)
1H NMR Spectrum (1D, 900 MHz, D2O, predicted)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, CDCl3, experimental)
Berberine
  • Argemone mexicana
  • Argemone spp.
  • Argemone subfusiformia
  • Argemone subfusiformis var.subinermis
  • Asteropyrum cavaleriei
  • Berberis aemulans
  • Berberis aquifolium
  • Berberis aristata
  • Berberis brandisiana
  • Berberis candidula
  • Berberis croatica
  • Berberis darwinii
  • Berberis densiflora
  • Berberis diaphana
  • Berberis dubia
  • Berberis heterobotrys
  • Berberis iliensis
  • Berberis integerrima
  • Berberis julianae
  • Berberis nervosa
  • Berberis numularis
  • Berberis oblonga
  • Berberis poirettii
  • Berberis potaninii
  • Berberis pruinosa
  • Berberis pseudanubalata
  • Berberis rigidifolia
  • Berberis spp.
  • Berberis stenophylla
  • Berberis thunbergii
  • Berberis turcomanica
  • Berberis vulgaris
  • Berberis wilsonae
  • Berberis wilsoniae
  • Chelidonium majus L.
  • Chelidonium spp.
  • Coptis chinensis
  • Coptis deltoidea
  • Coptis deltoides
  • Coptis gulinensis
  • Coptis japonica
  • Coptis linearisepala
  • Coptis omeiensis
  • Coptis spp.
  • Coptis teetoides
  • Corydalis amunca
  • Corydalis intermedia
  • Corydalis ledebouriana
  • Corydalis longicalcarata
  • Corydalis ophiocarpa
  • Corydalis remota
  • Corydalis solida
  • Corydalis spp.
  • Corydalis yanhusuo
  • Coscinium fenestratum
  • Eschscholtzia california
  • Evodia mellifolia
  • Evodia spp.
  • Glaucium arabicum
  • Hydrastis canadensis
  • Macleaya cordata
  • Magnolia biondii
  • Mahonia aquifolium
  • Mahonia bealei
  • Mahonia bodinieri
  • Mahonia confusa
  • Mahonia eurybracteata
  • Mahonia fortunei
  • Mahonia gracilipes
  • Mahonia japonica
  • Mahonia spp.
  • Mahonia veitchiorum
  • Nandina domestica
  • Nandina spp.
  • Naravelia zeylandica
  • Papaver albiflora
  • Papaver bracteatum
  • Papaver confine
  • Papaver pinnatifidum
  • Papaver radicatum
  • Papaver rhoeas chelidonides
  • Papaver rhopalothece
  • Papaver somniferum
  • Phellodendron amurense
  • Phellodendron chinense
  • Phellodendron chinensis
  • Phellodendron lavallei
  • Phellodendron wilsonii
  • Ranunculus serbicus
  • Stephania cepharantha
  • Stephania tetrandra
  • Stylophorum lasiocarpum
  • Thalictrum atriplex
  • Thalictrum faberi
  • Thalictrum flavum
  • Thalictrum foetidum
  • Thalictrum foliolosum
  • Thalictrum foliosum
  • Thalictrum glandulosissimum
  • Thalictrum honanense
  • Thalictrum longipedunculatum
  • Thalictrum microgynum
  • Thalictrum minus
  • Thalictrum orientale
  • Thalictrum petaloidum
  • Thalictrum przewalskii
  • Thalictrum purpurescens
  • Thalictrum simplex
  • Thalictrum spp.
  • Thalictrum symplex
  • Thalictrum thunbergii
  • Thalictrum wanqii
  • Toddalia aculeata Pers.
  • Toddalia spp.
  • Xanthorhiza simplicissima
  • Zanthoxylum spp.
  • Ziziphus jujuba
  • (show allshow less)
Data?1622842756C20H18NO4

336.3612 Da
336.12358 Da
1H NMR Spectrum (1D, 600 MHz, Methanol, simulated)
1H NMR Spectrum (1D, 600 MHz, Methanol, simulated)
1H NMR Spectrum (1D, 600 MHz, Methanol, simulated)
1H NMR Spectrum (1D, 600 MHz, Methanol, experimental)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, CD3OD, experimental)
Caffeine
  • Camellia assamica
  • Camellia irawadiensis
  • Camellia kissi
  • Camellia sinensis
  • Camellia sinensis var. sinensis
  • Camellia taliensis
  • Camellia thea
  • Camellia toliensis
  • Carica papaya
  • Citrus limon
  • Citrus maxima
  • Citrus paradisi
  • Coffea arabica
  • Coffea canephora
  • Coffea dewevrei
  • Coffea eugeniodes
  • Coffea eugenioides
  • Coffea excelsa
  • Coffea kianjavatensis
  • Coffea liberica
  • Coffea racemosa
  • Coffea salvatrix
  • Coffea spp
  • Coffea spp.
  • Cola acuminata
  • Cola sp.
  • Cola spp.
  • Firmiana simplex
  • Ilex cornuta
  • Ilex paraguariensis
  • Ilex paraguayensis
  • Paullinia cupana
  • Paullinia trifoliata
  • Scurrula atropurpurea
  • Thea siensis
  • Theobroma cacao
  • Theobroma grandiflorum
  • (show allshow less)
ThumbC8H10N4O2

194.1906 Da
194.08038 Da
1H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 400 MHz, H2O, simulated)
1H NMR Spectrum (1D, 500 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 400 MHz, H2O, simulated)
13C NMR Spectrum (1D, 400 MHz, H2O, experimental)
1H NMR Spectrum (1D, 500 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
1H NMR Spectrum (1D, 500 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, CDCl3, experimental)
Allantoin
  • Acanthopanax giraldii
  • Allium tuberosum Rottl.ex Spreng.
  • Arabidopsis thaliana
  • Aristolochia heterophylla Hemsl
  • Aristolochia pubescens
  • Auxemma oncocalyx
  • Glycine max
  • Rhinacanthus nasutus
  • Robinia pseudoacacia
  • Tournefortia sarmentosa
  • Vaccaria segetalis
  • (show allshow less)
ThumbC4H6N4O3

158.1154 Da
158.04399 Da
1H NMR Spectrum (1D, 500 MHz, H2O, experimental)
13C NMR Spectrum (1D, 400 MHz, H2O, simulated)
[1H, 13C]-HSQC NMR Spectrum (2D, 400 MHz, H2O, experimental)
Vanillic acid
  • Acer nikoense
  • Ailanthus integrifolia
  • Ajuga taiwanensis
  • Allium sativum
  • Alnus japonica
  • Amburana cearensis
  • Amphibolis antarctica
  • Amphibolis griffithii
  • Arabidopsis thaliana
  • Aristolochia manshuriensis
  • Aristolochia pubescens
  • Begonia nantoensis
  • Callicarpa integerrima
  • Carica papaya
  • Casearia membranacea
  • Catharanthus roseus
  • Ceratostigma willmottianum
  • Cichorium intybus
  • Cinnamomum philippinense
  • Cinnamomum subavenium MIQ.
  • Citrus sudachi
  • Cleidion spiciflorum (Burm. f.) Merr.
  • Colubrina faralaotra subsp.trichocarpa.
  • Crocus sativus
  • Curcuma domestica
  • Cymodocea rotundata
  • Cymodocea serrulata
  • Cyperus rotundus L.
  • Derris scandens
  • Dicliptera riparia
  • Dipsacus asper
  • Elaeagnus pungens
  • Engelhardia roxburghiana
  • Ephedra equisetina
  • Erica australis
  • Eriocaulon buergerianum
  • Fagara spp.
  • Fagara tessmannii Engl.
  • Falcaria vulgaris
  • Ficus septica
  • Glehnia littoralis
  • Gomphrena celosioides
  • Gossypium mexicanum
  • Grindelia aphanactis
  • Gymnadenia conopsea R.BR.
  • Halodule uninervis
  • Halodule wrightii
  • Halophila engelmannii
  • Halophila hawaiiana
  • Hibiscus taiwanensis
  • Humulus lupulus
  • Hydrangea chinensis
  • Hyoscyamus niger
  • Leptolaena diospyroidea
  • Leptolaena pauciflora
  • Magnolia denudata
  • Magnolia liliiflora
  • Mangifera indica
  • Matricaria chamomilla
  • Medicago sativa
  • Melia azedarach
  • Melilotus messanensis
  • Microtropis fokienensis
  • Microtropis japonica
  • Notopterygium incisum
  • Opuntia dillenii
  • Oryza sativa cv. Heugjinjubyeo
  • Oxalis corniculata
  • Paeonia hybrida
  • Panax ginseng
  • Paratecoma koraiensis
  • Pelargonium reniforme
  • Peperomia duclouxii C. DC.
  • Peperomia sui
  • Phellodendron amurense var.wilsonii
  • Phellodendron japonicum MAXIM
  • Phyllospadix scouleri
  • Phyllospadix serrulatus
  • Picea ajanensis
  • Picea obovata
  • Picrorhiza kurrooa
  • Picrorhiza kurrosa
  • Pinus sibirica
  • Plantago lanceolata
  • Plantago major
  • Plantago media
  • Polytrichum commune
  • Populus pseudosimonii
  • Posidonia australis
  • Posidonia oceanica
  • Prunus avium
  • Pseudolarix kaempferi Gord.
  • Pterocarpus santalinus
  • Punica granatum
  • Ranunculus baudotii
  • Rhaponticum carthamoides
  • Rosa canina
  • Rubia yunnanensis
  • Salvia officinalis
  • Solanum tuberosum
  • Sparganium stoloniferum
  • Spiraea formosana
  • Syringodium filiforme
  • Syringodium isoetifolium
  • Taraxacum formosanum
  • Taxus baccata
  • Tetracentron sinense
  • Thalassia hemprichii
  • Thalassia testudinum
  • Thalassodendron ciliatum
  • Toona ciliata
  • Trachelospermum asiaticum
  • Trichosanthes kirilowii
  • Triticum aestivum
  • Tupistra chinensis
  • Veronica peregrina L.
  • Viscum coloratum
  • Vittaria anguste-elongata
  • Zanthoxylum simulans
  • Zea mays L.
  • Zostera marina
  • (show allshow less)
ThumbC8H8O4

168.1480 Da
168.04226 Da
1H NMR Spectrum (1D, 500 MHz, H2O, experimental)
13C NMR Spectrum (1D, 500 MHz, DMSO, simulated)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, H2O, experimental)
Trehalose
  • Arabidopsis thaliana
  • Averrhoa carambola
  • Bacteria
  • Brassica oleracea L. ssp. Botrytis
  • Curcuma domestica
  • Fungi
  • Metazoa
  • Prunus avium
  • Solanum lycopersicum L.
  • Sorghum vulgare
  • Sporobolus stapfianus
  • (show allshow less)
ThumbC12H22O11

342.2965 Da
342.11621 Da
1H NMR Spectrum (1D, 500 MHz, H2O, experimental)
13C NMR Spectrum (1D, 400 MHz, H2O, simulated)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, H2O, experimental)
Itaconic acid
  • Sebertia acuminata
  • Solanum tuberosum
  • Triticum aestivum
  • Vicia faba
ThumbC5H6O4

130.0987 Da
130.02661 Da
1H NMR Spectrum (1D, 500 MHz, H2O, experimental)
1H NMR Spectrum (1D, 500 MHz, H2O, simulated)
1H NMR Spectrum (1D, 500 MHz, H2O, experimental)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, H2O, experimental)
Muramic acid
  • Eubacteria
ThumbC9H17NO7

251.2338 Da
251.10050 Da
1H NMR Spectrum (1D, 600 MHz, H2O, experimental)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, H2O, experimental)
Gentisic acid
  • Citrus cultivars
  • Citrus limonia
  • Citrus spp.
  • Cymodocea rotundata
  • Cymodocea serrulata
  • Eucalyptus grandis
  • Foeniculum vulgare
  • Gentiana spp.
  • Halodule uninervis
  • Halodule wrightii
  • Halophila hawaiiana
  • Helianthus tuberosus
  • Leptolaena diospyroidea
  • Leptolaena pauciflora
  • Olea europaea
  • Phyllospadix scouleri
  • Phyllospadix serrulatus
  • Plantago major
  • Posidonia oceanica
  • Prunus avium
  • Pterocarpus santalinus
  • Raphanus sativus
  • Rhamnus disperma
  • Rhaponticum carthamoides
  • Sesamum indicum
  • Syringodium filiforme
  • Syringodium isoetifolium
  • Taxus baccata
  • Thalassia hemprichii
  • Thalassia testudinum
  • Thalassodendron ciliatum
  • Vitis vinifera
  • Zostera capricorni
  • Zostera marina
  • (show allshow less)
ThumbC7H6O4

154.1210 Da
154.02661 Da
1H NMR Spectrum (1D, 600 MHz, H2O, experimental)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, H2O, experimental)
Trigonelline
  • Abrus precatorius
  • Achillea millefolium
  • Aeschyomene indica
  • Astragalus sinicus
  • Astragalus wootonii
  • Bauhinia candicans
  • Bauhinia forficata
  • Benincasa hispida
  • Canavalia ensiformis
  • Cannabis sativa
  • Carica papaya
  • Castanea sativa
  • Cicer arietinum
  • Coffea spp.
  • Cucurbita moschata
  • Desmodium triflorum
  • Dictamnus dasycarpus
  • Glycine max
  • Gnetum parvifolium
  • Hibiscus rosa-sinensis L
  • Hibiscus sabdariffa L.
  • Lablab purpureus
  • Macroptilium atropurpureum
  • Medicago sativa
  • Melilotus officinalis
  • Mirabilis jalapa
  • Phaseolus vulgaris
  • Pinellia ternata
  • Pisum sativum
  • Quisqualis indica
  • Retama raetam
  • Solanum lycopersicum
  • Solanum melongena
  • Strophanthus spp.
  • Trifolium pratense
  • Trigonella foenum-graceum
  • Trigonella foenum-graecum
  • Vigna unguiculata
  • (show allshow less)
ThumbC7H7NO2

137.1360 Da
137.04768 Da
1H NMR Spectrum (1D, 600 MHz, H2O, experimental)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, H2O, experimental)
p-Anisic acid
  • Annona purpurea
  • Croton draco Schltdl.& Cham.
  • Malva silvestris
  • Neolitsea acuminatissima
  • Nymphaea caerulea
  • Palicourea coriacea
  • Parthenium hysterophorus L.
  • Pimpinella anisum
  • Piper philippinum
  • Posidonia oceanica
  • Tabebuia avellanedae
  • Taraxacum formosanum
  • Trianthema portulacastrum
  • (show allshow less)
ThumbC8H8O3

152.1473 Da
152.04734 Da
1H NMR Spectrum (1D, 600 MHz, CDCl3, experimental)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, CDCl3, experimental)
alpha-Tocopherol
  • Aesculus hippocastanum Hort.
  • Amaranthus hypochondriacus L.
  • Arabidopsis thaliana
  • Arachis hypogaea
  • Avena sativa L.
  • Bixa orellana L.
  • Botryococcus braunii
  • Brassica oleracea var. italica
  • Calophyllum inophyllum L.
  • Carthamus tinctorius
  • Carum carvi L.
  • Cocos nucifera L.
  • Coriandrum sativum L.
  • Delphinium ajacis L.
  • Elaeis guineensis Jacq.
  • Feijoa sellowiana
  • Foeniculum vulgare L.
  • Gevuina avellana Mol.
  • Glycine max
  • Hevea brasiliensis Mull.Arg.
  • Hibiscus syriacus
  • Hippophae rhamnoides
  • Hordeum vulgare L.
  • Juglans regia L.
  • Litchi chinensis Sonn.
  • Lupinus albus
  • Lychnis coronaria
  • Machilus zuihoensis
  • Nicotiana tabacum L.
  • Oryza sativa L.
  • Pinus koraiensis
  • Rosmarinus officinalis L.
  • Schisandra chinensis
  • Sebertia acuminata
  • Secale cereale L.
  • Spinacia oleracea
  • Triticum aestivum
  • Uvaria pandensis
  • Vaccinium macrocarpon Aiton
  • Vitis vinifera L.
  • Zea mays L.
  • (show allshow less)
ThumbC29H50O2

430.7061 Da
430.38108 Da
1H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, CDCl3, experimental)
Erucic acid
  • Calophyllum calaba
  • Calophyllum inophyllum
  • Luzuriaga parviflora
  • Tropaeolum majus
ThumbC22H42O2

338.5677 Da
338.31848 Da
1H NMR Spectrum (1D, 600 MHz, Methanol, simulated)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, CD3OD, experimental)
Syringic acid
  • Plantae
  • Eubacteria
ThumbC9H10O5

198.1740 Da
198.05282 Da
1H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, H2O, experimental)
Genistein
  • Animalia
  • Plantae
Data?1628564076C15H10O5

270.2400 Da
270.05282 Da
13C NMR Spectrum (1D, 25 MHz, D2O, predicted)
1H NMR Spectrum (1D, 100 MHz, D2O, predicted)
13C NMR Spectrum (1D, 252 MHz, D2O, predicted)
1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)
13C NMR Spectrum (1D, 50 MHz, D2O, predicted)
1H NMR Spectrum (1D, 200 MHz, D2O, predicted)
13C NMR Spectrum (1D, 75 MHz, D2O, predicted)
1H NMR Spectrum (1D, 300 MHz, D2O, predicted)
13C NMR Spectrum (1D, 101 MHz, D2O, predicted)
1H NMR Spectrum (1D, 400 MHz, D2O, predicted)
13C NMR Spectrum (1D, 126 MHz, D2O, predicted)
1H NMR Spectrum (1D, 500 MHz, D2O, predicted)
13C NMR Spectrum (1D, 151 MHz, D2O, predicted)
1H NMR Spectrum (1D, 600 MHz, D2O, predicted)
13C NMR Spectrum (1D, 176 MHz, D2O, predicted)
1H NMR Spectrum (1D, 700 MHz, D2O, predicted)
13C NMR Spectrum (1D, 201 MHz, D2O, predicted)
1H NMR Spectrum (1D, 800 MHz, D2O, predicted)
13C NMR Spectrum (1D, 226 MHz, D2O, predicted)
1H NMR Spectrum (1D, 900 MHz, D2O, predicted)
13C NMR Spectrum (1D, 150 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 600 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 50 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 250 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 175 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 75 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 100 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 225 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 200 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 125 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 25 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 300 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 900 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 700 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 400 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 100 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 500 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 1000 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 800 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 200 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 600 MHz, Methanol, simulated)
1H NMR Spectrum (1D, 600 MHz, Methanol, simulated)
1H NMR Spectrum (1D, 600 MHz, Methanol, experimental)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, CD3OD, experimental)
Daidzein
  • Acca sellowiana
  • Albizia procera
  • Aloe vera
  • Arabidopsis thaliana
  • Arachis hypogaea
  • Brassica oleracea
  • Bupleurum scorzonerifolium
  • Cajanus cajan
  • Cicer arietinum
  • Crotalaria assamica
  • Crotalaria pallida
  • Dalbergia ecastaphyllum
  • Dalbergia odorifera
  • Dalbergia stevensonii
  • Derris oblonga
  • Erycibe expansa
  • Erythrina crista-galli
  • Erythrina indica
  • Erythrina latissima
  • Erythrina orientalis
  • Erythroxylum ulei
  • Euchresta formosana
  • Genista corsica
  • Genista tinctoria
  • Glycine max
  • Glycyrrhiza glabra
  • Glycyrrhiza inflata
  • Glycyrrhiza uralensis
  • Lespedeza bicolor
  • Maackia amurensis
  • Medicago arabica
  • Medicago sativa
  • Medicago truncatula
  • Pericopsis angolensis Baker.
  • Pericopsis eleta
  • Pericopsis laxiflora Benth.
  • Pericopsis mooniana
  • Phaseolus coccineus
  • Phaseolus spp.
  • Phaseolus vulgaris
  • Piptanthus nepalensis
  • Pisum sativum
  • Podocarpus amarus
  • Psoralea corylifolia
  • Pterocarpus marsupium
  • Pueraria Phaseoloides
  • Pueraria calycina
  • Pueraria candollei var. mirifica
  • Pueraria edulis
  • Pueraria lobata
  • Pueraria mirifica
  • Pueraria peduncularis
  • Pueraria thunbergiana
  • Pueraria tuberosa
  • Punica granatum
  • Retama raetam
  • Sophora flavescens
  • Sophora japonica
  • Sophora subprostrata
  • Taxus fuana
  • Taxus yunnanensis
  • Trifolium pratense
  • Trifolium repens
  • Tripterygium wilfordii
  • Ulex europaeus
  • Vigna radiata
  • (show allshow less)
Data?1628564076C15H10O4

254.2410 Da
254.05791 Da
13C NMR Spectrum (1D, 25 MHz, D2O, predicted)
1H NMR Spectrum (1D, 100 MHz, D2O, predicted)
13C NMR Spectrum (1D, 252 MHz, D2O, predicted)
1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)
13C NMR Spectrum (1D, 50 MHz, D2O, predicted)
1H NMR Spectrum (1D, 200 MHz, D2O, predicted)
13C NMR Spectrum (1D, 75 MHz, D2O, predicted)
1H NMR Spectrum (1D, 300 MHz, D2O, predicted)
13C NMR Spectrum (1D, 101 MHz, D2O, predicted)
1H NMR Spectrum (1D, 400 MHz, D2O, predicted)
13C NMR Spectrum (1D, 126 MHz, D2O, predicted)
1H NMR Spectrum (1D, 500 MHz, D2O, predicted)
13C NMR Spectrum (1D, 151 MHz, D2O, predicted)
1H NMR Spectrum (1D, 600 MHz, D2O, predicted)
13C NMR Spectrum (1D, 176 MHz, D2O, predicted)
1H NMR Spectrum (1D, 700 MHz, D2O, predicted)
13C NMR Spectrum (1D, 201 MHz, D2O, predicted)
1H NMR Spectrum (1D, 800 MHz, D2O, predicted)
13C NMR Spectrum (1D, 226 MHz, D2O, predicted)
1H NMR Spectrum (1D, 900 MHz, D2O, predicted)
13C NMR Spectrum (1D, 100 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 400 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 50 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 150 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 250 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 175 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 75 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 225 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 200 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 125 MHz, Dimethylsulfoxide-d6, simulated)
13C NMR Spectrum (1D, 25 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 300 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 900 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 700 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 100 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 500 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 1000 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 800 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 200 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 600 MHz, Dimethylsulfoxide-d6, simulated)
1H NMR Spectrum (1D, 600 MHz, DMSO, simulated)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, 100%_DMSO, experimental)
Cytarabine
  • Animalia
  • Plantae
ThumbC9H13N3O5

243.2166 Da
243.08552 Da
1H NMR Spectrum (1D, 500 MHz, H2O, experimental)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, H2O, experimental)
Anatabine
  • Nicotiana acaulis
  • Nicotiana acuminata
  • Nicotiana africana
  • Nicotiana alata
  • Nicotiana ameghinoi
  • Nicotiana amplexicaulis
  • Nicotiana arentsii
  • Nicotiana attenuata
  • Nicotiana benavidesii
  • Nicotiana benthamiana
  • Nicotiana bigelovii
  • Nicotiana bonariensis
  • Nicotiana cavicola
  • Nicotiana clevelandii
  • Nicotiana cordifolia
  • Nicotiana corymbosa
  • Nicotiana debneyi
  • Nicotiana excelsior
  • Nicotiana exigua
  • Nicotiana forgetiana
  • Nicotiana fragrans
  • Nicotiana glauca
  • Nicotiana glutinosa
  • Nicotiana goodspeedii
  • Nicotiana gossei
  • Nicotiana hesperis
  • Nicotiana ingulba
  • Nicotiana kawakamii
  • Nicotiana knightiana
  • Nicotiana langsdorffii
  • Nicotiana linearis
  • Nicotiana longibracteata
  • Nicotiana longiflora
  • Nicotiana maritima
  • Nicotiana megalosiphon
  • Nicotiana miersii
  • Nicotiana nesophila
  • Nicotiana noctiflora
  • Nicotiana nudicaulis
  • Nicotiana occidentalis
  • Nicotiana otophora
  • Nicotiana paniculata
  • Nicotiana pauciflora
  • Nicotiana petunioides
  • Nicotiana plumbaginifolia
  • Nicotiana raimondii
  • Nicotiana repanda
  • Nicotiana rosulata
  • Nicotiana rotundifolia
  • Nicotiana rustica
  • Nicotiana setchellii
  • Nicotiana simulans
  • Nicotiana solanifolia
  • Nicotiana spegazzinii
  • Nicotiana stocktonii
  • Nicotiana suaveolens
  • Nicotiana sylvestris
  • Nicotiana tabacum
  • Nicotiana thyrosiflora
  • Nicotiana tobacum
  • Nicotiana tomentosa
  • Nicotiana tomentosiformis
  • Nicotiana trigonophylla
  • Nicotiana undulata
  • Nicotiana velutina
  • Nicotiana wigandioides
  • (show allshow less)
ThumbC10H12N2

160.2157 Da
160.10005 Da
1H NMR Spectrum (1D, 600 MHz, Methanol, simulated)
1H NMR Spectrum (1D, 600 MHz, Methanol, simulated)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, CD3OD, experimental)
Hesperetin
  • Anthurium spp.
  • Brickellia vernicosa
  • Citrus aurantium L. var. amara
  • Citrus spp.
  • Dalbergia parviflora
  • Isatis indigotica
  • Medicago sativa
  • Mentha aquatica L.
  • Mentha spp.
  • Prunus persica
  • Rhaponticum carthamoides
  • Rosmarinus officinalis
  • Salvia officinalis
  • Taxus fuana
  • Taxus yunnanensis
  • (show allshow less)
ThumbC16H14O6

302.2788 Da
302.07904 Da
1H NMR Spectrum (1D, 600 MHz, Pyridine-d5, simulated)
13C NMR Spectrum (1D, 150 MHz, Pyridine-d5, simulated)
13C NMR Spectrum (1D, 50 MHz, Pyridine-d5, simulated)
13C NMR Spectrum (1D, 250 MHz, Pyridine-d5, simulated)
13C NMR Spectrum (1D, 175 MHz, Pyridine-d5, simulated)
13C NMR Spectrum (1D, 75 MHz, Pyridine-d5, simulated)
13C NMR Spectrum (1D, 100 MHz, Pyridine-d5, simulated)
13C NMR Spectrum (1D, 225 MHz, Pyridine-d5, simulated)
13C NMR Spectrum (1D, 200 MHz, Pyridine-d5, simulated)
13C NMR Spectrum (1D, 125 MHz, Pyridine-d5, simulated)
13C NMR Spectrum (1D, 25 MHz, Pyridine-d5, simulated)
1H NMR Spectrum (1D, 300 MHz, Pyridine-d5, simulated)
1H NMR Spectrum (1D, 900 MHz, Pyridine-d5, simulated)
1H NMR Spectrum (1D, 700 MHz, Pyridine-d5, simulated)
1H NMR Spectrum (1D, 400 MHz, Pyridine-d5, simulated)
1H NMR Spectrum (1D, 100 MHz, Pyridine-d5, simulated)
1H NMR Spectrum (1D, 500 MHz, Pyridine-d5, simulated)
1H NMR Spectrum (1D, 1000 MHz, Pyridine-d5, simulated)
1H NMR Spectrum (1D, 800 MHz, Pyridine-d5, simulated)
1H NMR Spectrum (1D, 200 MHz, Pyridine-d5, simulated)
Methylglutaric acid
  • Crotalaria dura
  • Crotalaria globifera
  • Triticum aestivum
ThumbC6H10O4

146.1412 Da
146.05791 Da
1H NMR Spectrum (1D, 600 MHz, H2O, experimental)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, H2O, experimental)
Octanol
  • Anthemis aciphylla BOISS.var.discoidea BOISS
  • Capillipedium parviflorum
  • Citrus reticulata
  • Citrus sinensis L.
  • Foeniculum vulgare
  • Mandragora autumnalis
  • Medicago sativa
  • Ophrys fusca
  • Ophrys lutea
  • Panax quinquefolium
  • Prunus avium
  • Rhodiola rosea L.
  • Santalum album
  • Saposhnikovia divaricata
  • Thymus X-porlock
  • Thymus eriocalyx
  • Tipuana tipu
  • (show allshow less)
Data?1628564076C8H18O

130.2279 Da
130.13577 Da
1H NMR Spectrum (1D, 600 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 25 MHz, D2O, predicted)
1H NMR Spectrum (1D, 100 MHz, D2O, predicted)
13C NMR Spectrum (1D, 252 MHz, D2O, predicted)
1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)
13C NMR Spectrum (1D, 50 MHz, D2O, predicted)
1H NMR Spectrum (1D, 200 MHz, D2O, predicted)
13C NMR Spectrum (1D, 75 MHz, D2O, predicted)
1H NMR Spectrum (1D, 300 MHz, D2O, predicted)
13C NMR Spectrum (1D, 101 MHz, D2O, predicted)
1H NMR Spectrum (1D, 400 MHz, D2O, predicted)
13C NMR Spectrum (1D, 126 MHz, D2O, predicted)
1H NMR Spectrum (1D, 500 MHz, D2O, predicted)
13C NMR Spectrum (1D, 151 MHz, D2O, predicted)
1H NMR Spectrum (1D, 600 MHz, D2O, predicted)
13C NMR Spectrum (1D, 176 MHz, D2O, predicted)
1H NMR Spectrum (1D, 700 MHz, D2O, predicted)
13C NMR Spectrum (1D, 201 MHz, D2O, predicted)
1H NMR Spectrum (1D, 800 MHz, D2O, predicted)
13C NMR Spectrum (1D, 226 MHz, D2O, predicted)
1H NMR Spectrum (1D, 900 MHz, D2O, predicted)
[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, CD3OD, experimental)
Displaying natural products 1 - 25 of 41066 in total