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Displaying natural products 951 - 975 of 290034 in total
NP-MRD ID
CAS Number
Compound Name Species of OriginChemical StructureChemical Formula
Average Mass
Monoisotopic Mass
NMR Spectra
Ochrocarpin F
  • Ochrocarpos punctatus
Data?1628564091C24H30O8

446.4960 Da
446.19407 Da
1H NMR Spectrum (1D, 500 MHz, CDCL3, experimental)
1H NMR Spectrum (1D, 500Mz, CDCL3, simulated)
Ochrocarpin E
  • Ochrocarpos punctatus
Data?1628564092C24H24O6

408.4500 Da
408.15729 Da
1H NMR Spectrum (1D, 500 MHz, CDCL3, experimental)
13C NMR Spectrum (1D, 100 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 125 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 150 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 175 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 200 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 225 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 25 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 250 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 50 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 75 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 100 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 1000 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 200 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 300 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 400 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 500 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 600 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 700 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 800 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 900 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 500Mz, CDCL3, simulated)
Saprionide
  • Salvia prionitis
Data?1628564093C21H15ClF3N5O2S2

525.9500 Da
525.03078 Da
1H NMR Spectrum (1D, 400 MHz, CDCL3, experimental)
1H NMR Spectrum (1D, 400Mz, CDCL3, simulated)
Saprirearine
  • Salvia prionitis
Data?1628564093C20H24O2

296.4100 Da
296.17763 Da
1H NMR Spectrum (1D, 400 MHz, CDCL3, experimental)
13C NMR Spectrum (1D, 100 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 125 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 150 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 175 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 200 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 225 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 25 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 250 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 50 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 75 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 100 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 1000 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 200 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 300 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 400 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 500 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 600 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 700 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 800 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 900 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 400Mz, CDCL3, simulated)
4-Hydroxysaprothoquinone
  • Salvia prionitis
Data?1628564094C20H26O3

314.4250 Da
314.18819 Da
1H NMR Spectrum (1D, 400 MHz, CDCL3, experimental)
13C NMR Spectrum (1D, 100 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 125 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 150 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 175 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 200 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 225 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 25 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 250 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 50 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 75 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 100 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 1000 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 200 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 300 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 400 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 500 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 600 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 700 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 800 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 900 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 400Mz, CDCL3, simulated)
Phebaclavin A
  • Phebalium clavatum
Data?1628564095C16H16O6

304.2980 Da
304.09469 Da
1H NMR Spectrum (1D, 300 MHz, CDCL3, experimental)
13C NMR Spectrum (1D, 100 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 125 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 150 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 175 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 200 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 225 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 25 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 250 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 50 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 75 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 100 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 1000 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 200 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 300 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 400 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 500 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 600 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 700 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 800 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 900 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 300Mz, CDCL3, simulated)
Phebaclavin B
  • Phebalium clavatum
Data?1628564095C16H16O6

304.2980 Da
304.09469 Da
1H NMR Spectrum (1D, 300 MHz, CDCL3, experimental)
1H NMR Spectrum (1D, 300Mz, CDCL3, simulated)
Phebaclavin C
  • Phebalium clavatum
Data?1628564096C15H14O5

274.2720 Da
274.08412 Da
1H NMR Spectrum (1D, 300 MHz, CDCL3, experimental)
1H NMR Spectrum (1D, 300Mz, CDCL3, simulated)
Phebaclavin D
  • Phebalium clavatum
Data?1628564096C16H16O7

320.2970 Da
320.08960 Da
1H NMR Spectrum (1D, 300 MHz, CDCL3, experimental)
13C NMR Spectrum (1D, 100 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 125 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 150 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 175 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 200 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 225 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 25 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 250 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 50 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 75 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 100 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 1000 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 200 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 300 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 400 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 500 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 600 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 700 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 800 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 900 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 300Mz, CDCL3, simulated)
Phebaclavin E
  • Phebalium clavatum
Data?1628564097C16H16O7

320.2970 Da
320.08960 Da
1H NMR Spectrum (1D, 300 MHz, CDCL3, experimental)
1H NMR Spectrum (1D, 300Mz, CDCL3, simulated)
Phebaclavin F
  • Phebalium clavatum
Data?1628564097C15H14O7

306.2700 Da
306.07395 Da
1H NMR Spectrum (1D, 300 MHz, Methanol, experimental)
1H NMR Spectrum (1D, 300Mz, Methanol, simulated)
Phebaclavin G
  • Phebalium clavatum
Data?1628564098C16H16O7

320.2970 Da
320.08960 Da
1H NMR Spectrum (1D, 300 MHz, CDCL3, experimental)
1H NMR Spectrum (1D, 300Mz, CDCL3, simulated)
Phebaclavin H
  • Phebalium clavatum
Data?1628564098C16H16O7

320.2970 Da
320.08960 Da
1H NMR Spectrum (1D, 300 MHz, CDCL3, experimental)
13C NMR Spectrum (1D, 100 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 125 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 150 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 175 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 200 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 225 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 25 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 250 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 50 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 75 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 100 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 1000 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 200 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 300 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 400 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 500 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 600 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 700 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 800 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 900 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 300Mz, CDCL3, simulated)
khrinone A
  • Dalbergia parviflora
Data?1628564099C12H16

160.2600 Da
160.12520 Da
1H NMR Spectrum (1D, 400 MHz, DMSO, experimental)
1H NMR Spectrum (1D, 400Mz, DMSO, simulated)
Khrinone B
  • Dalbergia parviflora
ThumbC16H12O7

316.2650 Da
316.05830 Da
1H NMR Spectrum (1D, 400 MHz, DMSO, experimental)
1H NMR Spectrum (1D, 400Mz, DMSO, simulated)
Khrinone C
  • Dalbergia parviflora
Data?1628564099C17H14O7

330.2920 Da
330.07395 Da
1H NMR Spectrum (1D, 400 MHz, Acetone, experimental)
1H NMR Spectrum (1D, 400Mz, Acetone, simulated)
Khrinone D
  • Dalbergia parviflora
Data?1628564100C17H12O7

328.2760 Da
328.05830 Da
1H NMR Spectrum (1D, 400 MHz, Acetone, experimental)
1H NMR Spectrum (1D, 400Mz, Acetone, simulated)
Khrinone E
  • Dalbergia parviflora
Data?1628564100C17H14O6

314.2930 Da
314.07904 Da
1H NMR Spectrum (1D, 400Mz, Methanol, simulated)
Rubiarbonone D
  • Rubia yunnanensis
Data?1628564103C30H48O3

456.7110 Da
456.36035 Da
1H NMR Spectrum (1D, 400 MHz, CDCL3, experimental)
13C NMR Spectrum (1D, 100 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 125 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 150 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 175 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 200 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 225 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 25 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 250 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 50 MHz, chcl3, predicted)
13C NMR Spectrum (1D, 75 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 100 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 1000 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 200 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 300 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 400 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 500 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 600 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 700 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 800 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 900 MHz, chcl3, predicted)
1H NMR Spectrum (1D, 400Mz, CDCL3, simulated)
CAPPAROSIDE A
  • Not Available
Data?1628564103C18H26O12

434.3940 Da
434.14243 Da
1H NMR Spectrum (1D, 400 MHz, Methanol, experimental)
1H NMR Spectrum (1D, 400Mz, Methanol, simulated)
KHAINAOSIDE A
  • Vitex glabrata
Data?1628564104C25H28O13

536.4860 Da
536.15299 Da
1H NMR Spectrum (1D, 400 MHz, Methanol, experimental)
1H NMR Spectrum (1D, 400Mz, Methanol, simulated)
KHAINAOSIDE B
  • Vitex glabrata
Data?1628564104C26H32O13

552.5290 Da
552.18429 Da
1H NMR Spectrum (1D, 400 MHz, Methanol, experimental)
1H NMR Spectrum (1D, 400Mz, Methanol, simulated)
KHAINAOSIDE C
  • Balanophora laxiflora
  • Vitex glabrata
Data?1628564105C25H28O11

504.4880 Da
504.16316 Da
1H NMR Spectrum (1D, 400 MHz, Methanol, experimental)
1H NMR Spectrum (1D, 400Mz, Methanol, simulated)
Stagonolide J
  • Cannabis sativa
  • Catha edulis
  • Stagonospora
Data?1628564106C4H10

58.1222 Da
58.07825 Da
13C NMR Spectrum (1D, 400 MHz, CDCL3, 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)
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)
13C NMR Spectrum (1D, 400Mz, CDCL3, simulated)
Gallicynoic acid B
  • Coriolopsis gallica
Data?1628564107C15H24O4

268.3530 Da
268.16746 Da
13C NMR Spectrum (1D, 400 MHz, Methanol, 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)
13C NMR Spectrum (1D, 100 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)
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, 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, 800 MHz, Methanol-d4, simulated)
1H NMR Spectrum (1D, 200 MHz, Methanol-d4, simulated)
1H NMR Spectrum (1D, 600 MHz, Methanol-d4, simulated)
13C NMR Spectrum (1D, 400Mz, Methanol, simulated)
Displaying natural products 951 - 975 of 290034 in total