NP0002725 | Ethanesulfonic acid | | ![Thumb](/structures/NP0002725/thumb.svg) | C2H5O3S
109.1200 Da 108.99649 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
|
NP0002726 | DL-alpha,epsilon-Diaminopimelic acid | | ![Thumb](/structures/NP0002726/thumb.svg) | C7H14N2O4
190.1971 Da 190.09536 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
|
NP0002727 | Ala-Ala | - Arabidopsis thaliana
- Escherichia coli
- Paraburkholderia phymatum
| ![Thumb](/structures/NP0002727/thumb.svg) | C6H12N2O3
160.1711 Da 160.08479 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
|
NP0002729 | Tropic acid | - Datura stamonium
- Erythroxylum australe
- Mandragora autumnalis
| ![Thumb](/structures/NP0002729/thumb.svg) | C9H10O3
166.1760 Da 166.06299 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
|
NP0002730 | p-Toluic acid | - Aloe africana
- Artemisia afra
- Homo sapiens
- Solanum tuberosum
| ![Thumb](/structures/NP0002730/thumb.svg) | C8H8O2
136.1479 Da 136.05243 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
|
NP0002731 | Acetylenedicarboxylic acid | | ![Thumb](/structures/NP0002731/thumb.svg) | C4H2O4
114.0560 Da 113.99531 Da | |
NP0002732 | 4-Chlorocatechol | | ![Thumb](/structures/NP0002732/thumb.svg) | C6H5ClO2
144.5560 Da 143.99781 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
|
NP0002733 | 5-Methylcytosine | - Anas platyrhynchos
- Anatidae
- Anser anser
- Bison bison
- Bos taurus X Bison bison
- Bos taurus
- Bubalus bubalis
- Capra aegagrus hircus
- Cervidae
- Cervus canadensis
- Columba
- Columbidae
- Dromaius novaehollandiae
- Equus caballus
- Gallus gallus
- Lagopus muta
- Leporidae
- Lepus timidus
- Luffa acutangula
- Melanitta fusca
- Meleagris gallopavo
- Numida meleagris
- Odocoileus
- Oryctolagus
- Ovis aries
- Phasianidae
- Phasianus colchicus
- Struthio camelus
- Sus scrofa
- Sus scrofa domestica
- (show allshow less)
| ![Thumb](/structures/NP0002733/thumb.svg) | C5H7N3O
125.1286 Da 125.05891 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 601 MHz, CDCl3, experimental) | 1H NMR Spectrum (1D, 601 MHz, CD3OD, experimental) |
|
NP0002734 | 4-Hydroxy-3-methoxycinnamaldehyde | | ![Thumb](/structures/NP0002734/thumb.svg) | C10H10O3
178.1846 Da 178.06299 Da | 1H NMR Spectrum (1D, 801 MHz, CD3OD, experimental) | 1H NMR Spectrum (1D, 801 MHz, CD3OD, experimental) | 1H NMR Spectrum (1D, 601 MHz, CD3OD, experimental) | 1H NMR Spectrum (1D, 601 MHz, CD3OD, experimental) |
|
NP0002736 | R-(-)-Citramalic acid | - Arabidopsis thaliana
- Hylocereus undatus
- Lotus corniculatus
- Lotus uliginosus
| ![Thumb](/structures/NP0002736/thumb.svg) | C5H8O5
148.1140 Da 148.03717 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
|
NP0002738 | DL-Homocysteine | | ![Thumb](/structures/NP0002738/thumb.svg) | C4H9NO2S
135.1800 Da 135.03540 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
|
NP0002739 | Cyclohexanol | - Abelmoschus esculentus
- Gossypium hirsutum
- Monodora myristica
- Ocimum basilicum
- Solanum lycopersicum var. lycopersicum
| ![Thumb](/structures/NP0002739/thumb.svg) | C6H12O
100.1589 Da 100.08882 Da | 13C NMR Spectrum (1D, 25 MHz, D2O, predicted) | 1H NMR Spectrum (1D, 100 MHz, D2O, predicted) | 1H NMR Spectrum (1D, 1000 MHz, D2O, predicted) | 13C NMR Spectrum (1D, 252 MHz, D2O, predicted) | 1H NMR Spectrum (1D, 200 MHz, D2O, predicted) | 13C NMR Spectrum (1D, 50 MHz, D2O, predicted) | 1H NMR Spectrum (1D, 300 MHz, D2O, predicted) | 13C NMR Spectrum (1D, 75 MHz, D2O, predicted) | 1H NMR Spectrum (1D, 400 MHz, D2O, predicted) | 13C NMR Spectrum (1D, 101 MHz, D2O, predicted) | 13C NMR Spectrum (1D, 126 MHz, D2O, predicted) | 1H NMR Spectrum (1D, 500 MHz, D2O, predicted) | 1H NMR Spectrum (1D, 600 MHz, D2O, predicted) | 13C NMR Spectrum (1D, 151 MHz, D2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, D2O, predicted) | 1H NMR Spectrum (1D, 700 MHz, D2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, D2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, D2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, D2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, D2O, predicted) |
|
NP0002740 | 4-Chlorobenzoic acid | | ![Thumb](/structures/NP0002740/thumb.svg) | C7H5ClO2
156.5660 Da 155.99781 Da | |
NP0002741 | D-Glucosaminic acid | - Medicago sativa
- Triticum aestivum
| ![Thumb](/structures/NP0002741/thumb.svg) | C6H13NO6
195.1705 Da 195.07429 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
|
NP0002742 | 4-Hydroxyphenylacetonitrile | - Angelica furcijuga KITAGAWA
- Brassica alba
- Brassica hirta
- Chlamydomonas reinhardtii
- Drypetes gossweileri
- Moringa oleifera
- Sinapis alba
- Sorghum bicolor
- (show allshow less)
| ![Thumb](/structures/NP0002742/thumb.svg) | C8H7NO
133.1473 Da 133.05276 Da | |
NP0002743 | D-Panthenol | | ![Thumb](/structures/NP0002743/thumb.svg) | C9H19NO4
205.2515 Da 205.13141 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
|
NP0002744 | D-Methionine | - Allium cepa
- Allium sativum
- Artemia salina
- Astragalus hamosus
- Brassica napus
- Calendula officinalis
- Cannabis sativa
- Cucumaria frondosa
- Daphnia pulex
- Flammulina velutipes
- Glycine max
- Gossypium hirsutum
- Indigofera schimperi
- Jatropha gossypifolia
- Juncus roemerianus
- Morchella angusticeps
- Nicotiana tabacum
- Opuntia ficus-indica
- Panax ginseng
- Pentaclethra macrophylla
- Phyllostachys nigra
- Pinus contorta
- Pinus densiflora
- Pinus ponderosa
- Pisum sativum
- Prunus domestica
- Psophocarpus tetragonolobus
- Ripariosida hermaphrodita
- Senna obtusifolia
- Spermacoce pusilla
- Suaeda aegyptiaca
- Tacca cristata
- (show allshow less)
| ![Thumb](/structures/NP0002744/thumb.svg) | C5H11NO2S
149.2110 Da 149.05105 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) | 1H NMR Spectrum (1D, 300 MHz, D2O, predicted) | 13C NMR Spectrum (1D, 75 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) | 1H NMR Spectrum (1D, 700 MHz, D2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, D2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, D2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, D2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, D2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, D2O, predicted) |
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NP0002745 | Cyclohexylamine | - Mus musculus
- Toddalia asiatica
| ![Thumb](/structures/NP0002745/thumb.svg) | C6H13N
99.1741 Da 99.10480 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
|
NP0002746 | Maleamic acid | - Pogostemon cablin
- Triticum aestivum
- Trypanosoma brucei
| ![Thumb](/structures/NP0002746/thumb.svg) | C4H5NO3
115.0874 Da 115.02694 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 600 MHz, CD3OD, simulated) | 13C NMR Spectrum (1D, 201 MHz, CD3OD, simulated) | 1H NMR Spectrum (1D, 600.133705802, CD3OD, simulated) | 1H NMR Spectrum (1D, 601 MHz, CD3OD, experimental) | 13C NMR Spectrum (1D, 202 MHz, CD3OD, experimental) | [1H , 1H ]-COSY NMR Spectrum (1D, 601 MHz, CD3OD, experimental) | [1H , 13C ]-HMBC NMR Spectrum (1D, 601 MHz, CD3OD, experimental) | [1H , 13C ]-HSQC NMR Spectrum (1D, 601 MHz, CD3OD, experimental) |
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NP0002747 | 4-Chlorophenol | | ![Thumb](/structures/NP0002747/thumb.svg) | C6H5ClO
128.5560 Da 128.00289 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
|
NP0002748 | trans-trans-Muconic acid | - Anas platyrhynchos
- Anatidae
- Anser anser
- Bison bison
- Bos taurus X Bison bison
- Bos taurus
- Bubalus bubalis
- Capra aegagrus hircus
- Cervidae
- Cervus canadensis
- Columba
- Columbidae
- Dromaius novaehollandiae
- Equus caballus
- Gallus gallus
- Lagopus muta
- Leporidae
- Lepus timidus
- Melanitta fusca
- Meleagris gallopavo
- Numida meleagris
- Odocoileus
- Oryctolagus
- Ovis aries
- Phasianidae
- Phasianus colchicus
- Struthio camelus
- Sus scrofa
- Sus scrofa domestica
- (show allshow less)
| ![Thumb](/structures/NP0002748/thumb.svg) | C6H6O4
142.1094 Da 142.02661 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
|
NP0002749 | Phthalaldehydic acid | | ![Thumb](/structures/NP0002749/thumb.svg) | C8H6O3
150.1330 Da 150.03169 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
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NP0002750 | DL-beta-Leucine | | ![Thumb](/structures/NP0002750/thumb.svg) | C6H13NO2
131.1729 Da 131.09463 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
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NP0002751 | Acetaldehyde oxime mixture of syn and anti | - Anas platyrhynchos
- Anatidae
- Anser anser
- Bison bison
- Bos taurus X Bison bison
- Bos taurus
- Bubalus bubalis
- Capra aegagrus hircus
- Cervidae
- Cervus canadensis
- Columba
- Columbidae
- Dromaius novaehollandiae
- Equus caballus
- Gallus gallus
- Lagopus muta
- Leporidae
- Lepus timidus
- Melanitta fusca
- Meleagris gallopavo
- Numida meleagris
- Odocoileus
- Oryctolagus
- Ovis aries
- Phasianidae
- Phasianus colchicus
- Struthio camelus
- Sus scrofa
- Sus scrofa domestica
- (show allshow less)
| ![Thumb](/structures/NP0002751/thumb.svg) | C2H5NO
59.0672 Da 59.03711 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
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NP0002752 | cis-1,2-cyclohexanediol | | ![Thumb](/structures/NP0002752/thumb.svg) | C6H12O2
116.1600 Da 116.08373 Da | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 1H NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) | 13C NMR Spectrum (1D, 500 MHz, D2O, experimental) |
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