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

NP0002623

Cyanuric acid

Acokanthera oblongifolia

C₃H₃N₃O₃

129.0742 Da
129.01744 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002625

D-Glucuronate

Annona squamosa
Gaultheria miqueliana

C₆H₁₀O₇

194.1394 Da
194.04265 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, 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)

NP0002626

D-Galactono-1,4-lactone

Talaromyces flavus

C₆H₁₀O₆

178.1400 Da
178.04774 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002627

(+-)-Acetylcarnitine

Not Available

C₉H₁₇NO₄

203.2380 Da
203.11576 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002628

5-Acetylamido-2-chloroaniline

Not Available

C₈H₉ClN₂O

184.6200 Da
184.04034 Da

¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002630

N-(2-Acetamido)iminodiacetic acid

Not Available

C₆H₁₀N₂O₅

190.1540 Da
190.05897 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002631

4-Aminoantipyrine

Not Available

C₁₁H₁₃N₃O

203.2450 Da
203.10586 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002633

L-Methionine methylsulfonium iodide

Not Available

C₆H₁₄INO₂S

291.1500 Da
290.97899 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002634

4-(2-Aminoethyl)morpholine

Not Available

C₆H₁₄N₂O

130.1882 Da
130.11061 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002635

Trimethyl phosphonoacetate

Not Available

C₅H₁₁O₅P

182.1120 Da
182.03441 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002636

N-Acetyl-D-glucosamine 1-phosphate

Escherichia coli K1

C₈H₁₆NO₉P

301.1877 Da
301.05627 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002637

D-Xylonate

Bergera koenegii
Carica papaya L.
Citrus X sinensis (L.) Osbeck (pro. sp.)
Murraya paniculata

C₅H₁₀O₆

166.1293 Da
166.04774 Da

¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002638

L-Tartaric acid

Cacalia hastata
Laetiporus sulphureus
Plantago major
Scutellaria baicalensis

C₄H₆O₆

150.0868 Da
150.01644 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002641

(1-Amino-1-phenylmethyl)phosphonic acid

Not Available

C₇H₁₀NO₃P

187.1350 Da
187.03983 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002642

5-(Acetylamino)-2-nitrobenzoic acid

Not Available

C₉H₈N₂O₅

224.1720 Da
224.04332 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002643

2-Amino-5-ethyl-1,3,4-thiadiazole

Not Available

C₄H₇N₃S

129.1800 Da
129.03607 Da

¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002644

alpha-Naphthoic acid

Not Available

C₁₁H₈O₂

172.1800 Da
172.05243 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002645

L-Ascorbate

Arabidopsis thaliana
Carica papaya L.
Citrus spp.
Colocasia escultenta
Daucus carota
Glycine max
Hippophae rhamnoides
Mangifera indica
Medicago sativa
Peperomia sui
Rubus idaeus
Zingiber officinale
(show all show less)

C₆H₈O₆

176.1241 Da
176.03209 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002647

DL-alpha-Glycerol phosphate

Apis cerana
Musca domestica

C₃H₉O₆P

172.0737 Da
172.01367 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002648

L-Arginine L-Glutamate

Not Available

C₁₁H₂₃N₅O₆

321.3340 Da
321.16483 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002649

Methyl N-acetyl-alpha-D-glucosaminide

Not Available

C₉H₁₇NO₆

235.2344 Da
235.10559 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002650

Kanamycin

Apis cerana
Elateriospermum tapos
Streptomyces hygroscopicus
Streptomyces kanamyceticus
Streptomyces lividans
Streptomyces tendae
(show all show less)

C₁₈H₃₆N₄O₁₁

484.5030 Da
484.23806 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002651

HEPES

Not Available

C₈H₁₈N₂O₄S

238.3050 Da
238.09873 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)

NP0002652

N-Acetyl-D-glucosamine 6-phosphate

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
Escherichia coli
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 all show less)

C₈H₁₆NO₉P

301.1880 Da
301.05627 Da

¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

NP0002654

L-(+)-Arabinose

Not Available

C₅H₁₀O₅

150.1299 Da
150.05282 Da

¹H NMR Spectrum (1D, 500 MHz, H₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, simulated)
¹H NMR Spectrum (1D, 400 MHz, D₂O, simulated)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, simulated)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, H₂O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 400 MHz, D₂O, experimental)

Browsing natural products

Filter by kingdom:

Filter by solvent:

Filter by spectral type:

Filter by nucleus:

Filter by spectra quality:

Filter by assignment quality: