NP-MRD: Browsing natural products

NP-MRD ID
CAS Number Compound Name Species of Origin Chemical Structure Chemical Formula
Average Mass
Monoisotopic Mass NMR Spectra

NP0043951

Phomopsichalasin F

Phomopsis sp. Xy21

C₂₈H₃₇NO₃

435.6080 Da
435.27734 Da

¹³C NMR Spectrum (1D, 100 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 400 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 50 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 150 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 250 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 175 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 75 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 225 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 200 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 125 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 25 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 300 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 900 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 700 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 100 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 500 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 1000 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 800 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 200 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 600 MHz, Acetone-d6, simulated)

NP0043952

Phomopsichalasin G

Phomopsis sp. Xy21

C₂₈H₃₇NO₄

451.6070 Da
451.27226 Da

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)

NP0043953

Phorbaketal E

Monanchora QM G331990

C₂₅H₃₄O₅

414.5420 Da
414.24062 Da

¹³C NMR Spectrum (1D, 125 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 500 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 50 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 150 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 250 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 175 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 75 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 100 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 225 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 200 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 25 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 300 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 900 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 700 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 400 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 100 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 1000 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 800 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 200 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 600 MHz, Methanol-d4, simulated)

NP0043954

Phorbaketal G

Monanchora QM G331990

C₂₇H₃₈O₇

474.5940 Da
474.26175 Da

¹³C NMR Spectrum (1D, 125 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 500 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 50 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 150 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 250 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 175 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 75 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 100 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 225 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 200 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 25 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 300 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 900 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 700 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 400 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 100 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 1000 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 800 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 200 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 600 MHz, Methanol-d4, simulated)

NP0043955

Polydatin

Abies nephrolepis
Ampelopsis brevipedunculata var hancei
Ampelopsis glandulosa
Angophora cordifolia
Arachis hypogaea
Astragalus complanatus
Corymbia haematoxylon
Corymbia papuana
Corymbia tessellaris
Cotylelobium lanceolatum
Cyclocarya paliurus
Cynomorium songaricum
Erythrophleum lasianthum
Eskemukerjea megacarpum HARA
Eucalyptus abergiana
Eucalyptus astringens
Eucalyptus caesia
Eucalyptus calophylla
Eucalyptus campospe
Eucalyptus citriodora
Eucalyptus decorticans
Eucalyptus dichromophloia
Eucalyptus eremophila
Eucalyptus erythrophloia
Eucalyptus ficifolia
Eucalyptus gardneri
Eucalyptus griffithsii
Eucalyptus grossa
Eucalyptus gummifera
Eucalyptus intermedia
Eucalyptus maculata
Eucalyptus melonophlo
Eucalyptus nowraensis
Eucalyptus occidentalis
Eucalyptus polycarpa
Eucalyptus pruinosa
Eucalyptus rubida
Eucalyptus sargentii
Eucalyptus sideroxylon
Eucalyptus spathulata
Eucalyptus stricklandii
Eucalyptus terminalis
Eucalyptus trachyphloia
Eucalyptus wandoo
Eucalyptus woodwardii
Fagopyrum megacarpum
Fallopia multiflora
Foeniculum vulgare
Guibourtia tessmannii
Hopea hainanensis
Humulus lupulus
Juniperus polycarpos
Lens culinaris
Loiseleuria procumbens
Loiseleuria procumbens (L.) Desv.
Lysidice brevicalyx
Lysidice brevicalyx Wei
Lysidice rhodostegia
Parthenocissus quinquefolia
Parthenocissus tricuspidata
Picea abies
Picea glehnii
Picea jezoensis
Picea koraiensis
Picea obovata
Picea sitchensis
Pinus koraiensis
Pleuropterus ciliinervis
Polygonum cuspidatum
Polygonum multiflorum
Polygonum sachalinensis
Prunus dulcis
Rheum palaestinum
Rheum palmatum
Rheum tanguticum
Rumex bucephalophorus
Schoenocaulon officinale
Shorea roxburghii
Smilax glabra
Sorghum bicolor
Spiraea formosana
Upuna borneensis
Vateria indica
Vatica diospyroides
Vatica rassak
Veratrum dahuricum
Veratrum grandiflorum
Veratrum taliense
Vitis rupestris
Vitis vinifera
Vitis vinifera L.
(show all show less)

C₂₀H₂₂O₈

390.3880 Da
390.13147 Da

¹³C NMR Spectrum (1D, 75 MHz, Dimethylsulfoxide-d6, simulated)
¹H NMR Spectrum (1D, 200 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, 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, 600 MHz, Dimethylsulfoxide-d6, simulated)
¹³C NMR Spectrum (1D, 50 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 150 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 250 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 175 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 75 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 225 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 125 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 25 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 300 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 900 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 700 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 400 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 500 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 1000 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 800 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 600 MHz, Dmso, predicted)

NP0043956

Polyketide apiosporic acid

Arthrinium arundinis

C₁₃H₂₀O₃

224.3000 Da
224.14124 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, 300 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 300 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 50 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 150 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 250 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 175 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 75 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 100 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 225 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 200 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 125 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 25 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 900 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 700 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 400 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 100 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 500 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 1000 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 800 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 200 MHz, Acetone-d6, simulated)
¹H NMR Spectrum (1D, 600 MHz, Acetone-d6, simulated)
¹³C NMR Spectrum (1D, 50 MHz, acetone, predicted)
¹³C NMR Spectrum (1D, 150 MHz, acetone, predicted)
¹³C NMR Spectrum (1D, 250 MHz, acetone, predicted)
¹³C NMR Spectrum (1D, 175 MHz, acetone, predicted)
¹³C NMR Spectrum (1D, 75 MHz, acetone, predicted)
¹³C NMR Spectrum (1D, 100 MHz, acetone, predicted)
¹³C NMR Spectrum (1D, 225 MHz, acetone, predicted)
¹³C NMR Spectrum (1D, 200 MHz, acetone, predicted)
¹³C NMR Spectrum (1D, 125 MHz, acetone, predicted)
¹³C NMR Spectrum (1D, 25 MHz, acetone, predicted)
¹H NMR Spectrum (1D, 300 MHz, acetone, predicted)
¹H NMR Spectrum (1D, 900 MHz, acetone, predicted)
¹H NMR Spectrum (1D, 700 MHz, acetone, predicted)
¹H NMR Spectrum (1D, 400 MHz, acetone, predicted)
¹H NMR Spectrum (1D, 100 MHz, acetone, predicted)
¹H NMR Spectrum (1D, 500 MHz, acetone, predicted)
¹H NMR Spectrum (1D, 1000 MHz, acetone, predicted)
¹H NMR Spectrum (1D, 800 MHz, acetone, predicted)
¹H NMR Spectrum (1D, 200 MHz, acetone, predicted)
¹H NMR Spectrum (1D, 600 MHz, acetone, predicted)

NP0043957

Ponticin

Eucalyptus sideroxylon
Guibourtia coleosperma
Polygonum multiflorum
Rheum altaicum
Rheum australe
Rheum collineanum
Rheum cordatum
Rheum officinale
Rheum palaestinum
Rheum palmatum
Rheum rhaponticum
Rheum undulatum
Trigonella foenum-graecum
(show all show less)

C₂₁H₂₄O₉

420.4140 Da
420.14203 Da

¹³C NMR Spectrum (1D, 75 MHz, Dimethylsulfoxide-d6, simulated)
¹H NMR Spectrum (1D, 200 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, 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, 600 MHz, Dimethylsulfoxide-d6, simulated)

NP0043958

Quercetin 3-beta-O-glucuronide

Adiantum spp.
Alnus sieboldiana
Alpinia elatior
Anethum foeniculum
Anethum sowa
Arachis hypogaea
Arnica chamissonis
Beilschmiedia miersii
Callistemon citrinus
Campanula glomerata
Campanula glomerata L.
Cautleya spicata
Centella asiatica
Centella erecta
Clematis rehderiana
Clematis stans
Cornus mas
Corsinia coriandrina
Corylus heterophylla
Cyclocarya paliurus
Diospyros cathayensis
Epilobium hirsutum
Eriogonum nudum
Eucalyptus consideniana
Eucalyptus globulus
Euphorbia retusa
Euphorbia spp.
Foeniculum vulgare
Fuchsia fulgens
Gaultheria miqueliana
Gaultheria pyroloides
Geranium dissectum
Gutierrezia wrightii
Hamamelis virginiana
Hedychium thyrsiforme
Hypericum aucheri
Hypericum henryi
Hypericum hirsutum
Hypericum laricifolium
Hypericum perforatum
Monsonia spp.
Morella rubra
Nelumbo nucifera
Orlaya spp. Lasthenia spp.
Persicaria decipiens
Phaseolus vulgaris
Philydrum lanuginosum
Polygonum hydropiper L.
Polygonum sachalinense
Polygonum viviparum
Populus grandidentata
Potentilla anserina
Psidium guaijava
Rosa luciae
Rosa multiflora
Rubus glaucus
Salvia blepharophylla
Schinus molle
Stephanodoria tomentella
Tamarix nilotica
Theobroma grandiflorum
Vigna radiata
Vitis vinifera
Vitis vinifera L.
(show all show less)

C₂₁H₁₈O₁₃

478.3620 Da
478.07474 Da

¹³C NMR Spectrum (1D, 150 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 600 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 50 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 250 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 175 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 75 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 100 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 225 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 200 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 125 MHz, Methanol-d4, simulated)
¹³C NMR Spectrum (1D, 25 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 300 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 900 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 700 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 400 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 100 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 500 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 1000 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 800 MHz, Methanol-d4, simulated)
¹H NMR Spectrum (1D, 200 MHz, Methanol-d4, simulated)

NP0043960

Rhoifolin

Acmella oleracea
Acorus calamus
Astragalus peregrinus
Asystasia gangetica
Asystasia gangetica L.
Bryum pseudotriquetrum
Carallia brachiata
Chrysanthemum morifolium
Citrus aurantium
Citrus limon
Citrus maxima
Citrus paradisi
Citrus sinensis
Citrus unshiu
Euchresta japonica
Gnetum africanum
Gonocaryum calleryanum
Kummerowia striata
Lawsonia alba
Lawsonia inermis
Ligustrum robustum
Lonicera gracilipes
Lonicera japonica
Lupinus luteus
Matricaria recutita
Plagiomnium ciliare
Pyrrosia serpens
Reichardia picroides
Rhus succedanea
Rhus sylvestris
Serenoa repens
Syringa afghanica
Syringa persica
Toxicodendron succedaneum
Trachelospermum asiaticum var.intermedium
Trachelospermum jasminoides
Valeriana hardwickii
Vicia faba
(show all show less)

C₂₇H₃₀O₁₄

578.5187 Da
578.16356 Da

¹³C NMR Spectrum (1D, 150 MHz, Pyridine-d5, simulated)
¹H NMR Spectrum (1D, 600 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)

NP0043961

Robinetin

Acacia dealbata
Acacia mearnsii
Adenanthera pavonina
Albizia pedicellata
Albizia splendens
Archidendron clypearia
Burkea africana
Butea spp.
Capsella bursa-pastoris
Gleditsia monosperma
Gliricidia sepium
Intsia bijuga
Intsia palembanica
Millettia stuhlmannii
Robinia pseudoacacia
(show all show less)

C₁₅H₁₀O₇

302.2380 Da
302.04265 Da

¹³C NMR Spectrum (1D, 150 MHz, Pyridine-d5, simulated)
¹H NMR Spectrum (1D, 600 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)

NP0043968

Schizolaenone B

Schizolaena hystrix

C₃₀H₃₆O₆

492.6120 Da
492.25119 Da

¹³C NMR Spectrum (1D, Chloroform-d, simulated)
¹H NMR Spectrum (1D, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 50 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 150 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 250 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 175 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 75 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 100 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 225 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 200 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 125 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 25 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 300 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 900 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 700 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 400 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 100 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 500 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 1000 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 800 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 200 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 600 MHz, Chloroform-d, simulated)

NP0043969

Scoparasin C

Eutypella scoparia

C₂₈H₃₃NO₈

511.5710 Da
511.22062 Da

¹³C NMR Spectrum (1D, 75 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 300 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 50 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 150 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 250 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 175 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 100 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 225 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 200 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 125 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 25 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 900 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 700 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 400 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 100 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 500 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 1000 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 800 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 200 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 600 MHz, Chloroform-d, simulated)

NP0043970

Sesquibastadin A

Ianthella basta

C₅₁H₄₄Br₆N₆O₁₂

1412.3670 Da
1405.81175 Da

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)

NP0043971

Sigmoidin A

Antiaris toxicaria
Erythrina abyssinica
Erythrina latissima
Erythrina sigmoidea
Sigmoidea

C₂₅H₂₈O₆

424.4930 Da
424.18859 Da

¹³C NMR Spectrum (1D, 75 MHz, Dimethylsulfoxide-d6, simulated)
¹H NMR Spectrum (1D, 300 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, 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, Dimethylsulfoxide-d6, simulated)
¹³C NMR Spectrum (1D, 50 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 150 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 250 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 175 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 75 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 225 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 125 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 25 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 300 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 900 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 700 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 400 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 500 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 1000 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 800 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 600 MHz, Dmso, predicted)

NP0043972

Sigmoidin B

Erythrina abyssinica
Erythrina latissima
Erythrina sigmoidea
Glycyrrhiza glabra
Glycyrrhiza inflata
Glycyrrhiza uralensis
Sigmoidea
(show all show less)

C₂₀H₂₀O₆

356.3740 Da
356.12599 Da

¹³C NMR Spectrum (1D, 75 MHz, Dimethylsulfoxide-d6, simulated)
¹H NMR Spectrum (1D, 300 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, 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, Dimethylsulfoxide-d6, simulated)
¹³C NMR Spectrum (1D, 50 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 150 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 250 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 175 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 75 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 225 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 125 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 25 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 300 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 900 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 700 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 400 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 500 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 1000 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 800 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 600 MHz, Dmso, predicted)

NP0043973

Sigmoidin C

Erythrina abyssinica
Erythrina eriotriocha
Erythrina latissima
Erythrina sigmoidea
Sigmoidea

C₂₀H₁₈O₆

354.3580 Da
354.11034 Da

¹³C NMR Spectrum (1D, 75 MHz, Dimethylsulfoxide-d6, simulated)
¹H NMR Spectrum (1D, 300 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, 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, Dimethylsulfoxide-d6, simulated)
¹³C NMR Spectrum (1D, 50 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 150 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 250 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 175 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 75 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 225 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 125 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 25 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 300 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 900 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 700 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 400 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 500 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 1000 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 800 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 600 MHz, Dmso, predicted)

NP0043974

Simplicilliumtide A

Simplicillium obclavatum

C₂₈H₃₈N₄O₅

510.6350 Da
510.28422 Da

¹³C NMR Spectrum (1D, 125 MHz, Dimethylsulfoxide-d6, simulated)
¹H NMR Spectrum (1D, 500 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, 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, 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, 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)

NP0043975

Simplicilliumtide B

Simplicillium obclavatum

C₂₈H₃₈N₄O₅

510.6350 Da
510.28422 Da

¹³C NMR Spectrum (1D, 125 MHz, Dimethylsulfoxide-d6, simulated)
¹H NMR Spectrum (1D, 500 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, 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, 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, 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)
¹³C NMR Spectrum (1D, 50 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 150 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 250 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 175 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 75 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 225 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 125 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 25 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 300 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 900 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 700 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 400 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 500 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 1000 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 800 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 600 MHz, Dmso, predicted)

NP0043976

Simplicilliumtide C

Simplicillium obclavatum

C₂₄H₃₇N₃O₅

447.5760 Da
447.27332 Da

¹³C NMR Spectrum (1D, 125 MHz, Dimethylsulfoxide-d6, simulated)
¹H NMR Spectrum (1D, 500 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, 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, 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, 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)
¹³C NMR Spectrum (1D, 50 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 150 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 250 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 175 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 75 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 225 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 125 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 25 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 300 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 900 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 700 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 400 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 500 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 1000 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 800 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 600 MHz, Dmso, predicted)

NP0043977

Simplicilliumtide D

Simplicillium obclavatum

C₂₄H₃₇N₃O₆

463.5750 Da
463.26824 Da

¹³C NMR Spectrum (1D, 125 MHz, Dimethylsulfoxide-d6, simulated)
¹H NMR Spectrum (1D, 500 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, 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, 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, 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)
¹³C NMR Spectrum (1D, 50 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 150 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 250 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 175 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 75 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 225 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 125 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 25 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 300 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 900 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 700 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 400 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 500 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 1000 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 800 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 600 MHz, Dmso, predicted)

NP0043978

Simplicilliumtide E

Simplicillium obclavatum

C₂₅H₃₉N₃O₆

477.6020 Da
477.28389 Da

¹³C NMR Spectrum (1D, 125 MHz, Dimethylsulfoxide-d6, simulated)
¹H NMR Spectrum (1D, 500 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, 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, 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, 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)
¹³C NMR Spectrum (1D, 50 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 150 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 250 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 175 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 75 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 225 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 125 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 25 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 300 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 900 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 700 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 400 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 500 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 1000 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 800 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 600 MHz, Dmso, predicted)

NP0043979

Simplicilliumtide F

Simplicillium obclavatum

C₂₃H₃₅N₃O₅

433.5490 Da
433.25767 Da

¹³C NMR Spectrum (1D, 125 MHz, Dimethylsulfoxide-d6, simulated)
¹H NMR Spectrum (1D, 500 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, 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, 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, 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)

NP0043980

Simplicilliumtide G

Simplicillium obclavatum

C₁₈H₂₆N₂O₅

350.4150 Da
350.18417 Da

¹³C NMR Spectrum (1D, 125 MHz, Dimethylsulfoxide-d6, simulated)
¹H NMR Spectrum (1D, 500 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, 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, 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, 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)
¹³C NMR Spectrum (1D, 50 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 150 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 250 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 175 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 75 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 225 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 125 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 25 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 300 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 900 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 700 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 400 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 500 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 1000 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 800 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 600 MHz, Dmso, predicted)

NP0043981

Simplicilliumtide H

Simplicillium obclavatum

C₁₈H₂₆N₂O₄

334.4160 Da
334.18926 Da

¹³C NMR Spectrum (1D, 125 MHz, Dimethylsulfoxide-d6, simulated)
¹H NMR Spectrum (1D, 500 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, 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, 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, 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)
¹³C NMR Spectrum (1D, 50 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 150 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 250 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 175 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 75 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 225 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 125 MHz, Dmso, predicted)
¹³C NMR Spectrum (1D, 25 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 300 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 900 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 700 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 400 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 100 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 500 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 1000 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 800 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 200 MHz, Dmso, predicted)
¹H NMR Spectrum (1D, 600 MHz, Dmso, predicted)

NP0043982

Sinubrasolide A

Sinularia brassica

C₂₈H₃₈O₄

438.6080 Da
438.27701 Da

¹³C NMR Spectrum (1D, 100 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 400 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 50 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 150 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 250 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 175 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 75 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 225 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 200 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 125 MHz, Chloroform-d, simulated)
¹³C NMR Spectrum (1D, 25 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 300 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 900 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 700 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 100 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 500 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 1000 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 800 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 200 MHz, Chloroform-d, simulated)
¹H NMR Spectrum (1D, 600 MHz, Chloroform-d, simulated)

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