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Displaying natural products 281151 - 281175 of 281728 in total
NP-MRD ID
CAS Number
Compound Name Species of OriginChemical StructureChemical Formula
Average Mass
Monoisotopic Mass
NMR Spectra
(E)-3-((1R,6R,7S)-4,6,7-trimethyl-3,5-dioxo-2-oxabicyclo[2.2.1]heptan-7-yl)acrylaldehyde
  • Not Available
ThumbC12H14O4

222.2400 Da
222.08921 Da
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-ROESY NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
(E)-3-((2S,5S,6S)-5-hydroxy-3,5,6-trimethyl-5,6-dihydro-2H-pyran-2-yl)but-2-enal
  • Not Available
ThumbC12H18O3

210.2730 Da
210.12559 Da
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-ROESY NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
Prugosene A3
  • Not Available
ThumbC28H36O5

452.5910 Da
452.25627 Da
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-ROESY NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
(1R,5S,6S,7S)-5-hydroxy-7-((1E,3E,5E,7E,9E)-10-((2R,5S,6S)-5-hydroxy-3,5,6-trimethyl-5,6-dihydro-2H-pyran-2-yl)undeca-1,3,5,7,9-pentaen-1-yl)-4,6,7-trimethyl-2-oxabicyclo[2.2.1]heptan-3-one
  • Not Available
ThumbC28H38O5

454.6070 Da
454.27192 Da
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-ROESY NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
(1R,5R,6S,7S)-5-hydroxy-7-((1E,3E,5E,7E,9E)-10-((2R,5S,6S)-5-hydroxy-3,5,6-trimethyl-5,6-dihydro-2H-pyran-2-yl)undeca-1,3,5,7,9-pentaen-1-yl)-4,6,7-trimethyl-2-oxabicyclo[2.2.1]heptan-3-one
  • Not Available
ThumbC28H38O5

454.6070 Da
454.27192 Da
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-ROESY NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
(E)-3-((2S,3R,6S)-3-hydroxy-3,5,6-trimethyl-3,6-dihydro-2H-pyran-2-yl)but-2-enal
  • Not Available
ThumbC12H18O3

210.2730 Da
210.12559 Da
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-ROESY NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
Paraphaeolactone A2
  • Not Available
ThumbC10H12O4

196.2020 Da
196.07356 Da
13C NMR Spectrum (1D, 126 MHz, C3D6O, experimental)
[1H , 13C ]-HMQC NMR Spectrum (1D, 501 MHz, C3D6O, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 501 MHz, C3D6O, experimental)
1H NMR Spectrum (1D, 501 MHz, C3D6O, experimental)
1H NMR Spectrum (1D, 501 MHz, C3D6O, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 501 MHz, C3D6O, experimental)
Paraphaeolactone A1
  • Not Available
ThumbC10H12O4

196.2020 Da
196.07356 Da
13C NMR Spectrum (1D, 126 MHz, C3D6O, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 501 MHz, C3D6O, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 501 MHz, CD3OD, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 501 MHz, C3D6O, experimental)
1H NMR Spectrum (1D, 501 MHz, C3D6O, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 501 MHz, C3D6O, experimental)
phellinhart C
  • Not Available
ThumbC15H22O3

250.3380 Da
250.15689 Da
13C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
1H NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
phellinhart B
  • Not Available
ThumbC14H20O3

236.3110 Da
236.14124 Da
13C NMR Spectrum (1D, 151 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 151 MHz, CDCl3, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 601 MHz, CDCl3, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 601 MHz, CDCl3, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 601 MHz, CDCl3, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 601 MHz, CDCl3, experimental)
1H NMR Spectrum (1D, 601 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 151 MHz, CDCl3, experimental)
phellinhart A
  • Not Available
ThumbC15H22O4

266.3370 Da
266.15181 Da
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
4F-Bacillamide A
  • Not Available
ThumbC16H14FN3O2S

331.3700 Da
331.07908 Da
1H NMR Spectrum (1D, 400 MHz, C2D6OS, simulated)
1H NMR Spectrum (1D, 377 MHz, C2D6OS, experimental)
1H NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
N-acetyltryptamine
  • Not Available
ThumbC12H14N2O

202.2570 Da
202.11061 Da
13C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
1H NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
6F-Bacillamide C
  • Not Available
ThumbC18H19FN4O2S

374.4300 Da
374.12128 Da
1H NMR Spectrum (1D, 400 MHz, C2D6OS, simulated)
1H NMR Spectrum (1D, 377 MHz, C2D6OS, experimental)
1H NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
6F-N-acetyltryptamine
  • Not Available
ThumbC12H13FN2O

220.2470 Da
220.10119 Da
1H NMR Spectrum (1D, 400 MHz, C2D6OS, simulated)
1H NMR Spectrum (1D, 377 MHz, C2D6OS, experimental)
1H NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
6F-Bacillamide A
  • Not Available
ThumbC16H14FN3O2S

331.3700 Da
331.07908 Da
1H NMR Spectrum (1D, 400 MHz, C2D6OS, simulated)
1H NMR Spectrum (1D, 377 MHz, C2D6OS, experimental)
1H NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
Bacillamide A
  • Not Available
ThumbC16H15N3O2S

313.3800 Da
313.08850 Da
13C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
1H NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
4F-Bacillamide C
  • Not Available
ThumbC18H19FN4O2S

374.4300 Da
374.12128 Da
1H NMR Spectrum (1D, 400 MHz, C2D6OS, simulated)
1H NMR Spectrum (1D, 377 MHz, C2D6OS, experimental)
1H NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
5F-Bacillamide C
  • Not Available
ThumbC18H19FN4O2S

374.4300 Da
374.12128 Da
1H NMR Spectrum (1D, 400 MHz, C2D6OS, simulated)
1H NMR Spectrum (1D, 377 MHz, C2D6OS, experimental)
1H NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
Iturin A6
  • Not Available
ThumbC50H78N12O14

1071.2440 Da
1070.57605 Da
Not Available
5F-Bacillamide A
  • Not Available
ThumbC16H14FN3O2S

331.3700 Da
331.07908 Da
1H NMR Spectrum (1D, 377 MHz, C2D6OS, experimental)
Iturin A8
  • Not Available
ThumbC51H80N12O14

1085.2710 Da
1084.59170 Da
Not Available
4F-N-acetyltryptamine
  • Not Available
ThumbC12H13FN2O

220.2470 Da
220.10119 Da
1H NMR Spectrum (1D, 400 MHz, C2D6OS, simulated)
1H NMR Spectrum (1D, 377 MHz, C2D6OS, experimental)
1H NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
5F-N-acetyltryptamine
  • Not Available
ThumbC12H13FN2O

220.2470 Da
220.10119 Da
1H NMR Spectrum (1D, 400 MHz, C2D6OS, simulated)
1H NMR Spectrum (1D, 377 MHz, C2D6OS, experimental)
1H NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
Iturin A2
  • Not Available
ThumbC48H74N12O14

1043.1900 Da
1042.54475 Da
Not Available
Displaying natural products 281151 - 281175 of 281728 in total