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Displaying natural products 1226 - 1250 of 281838 in total
NP-MRD ID
CAS Number
Compound Name Species of OriginChemical StructureChemical Formula
Average Mass
Monoisotopic Mass
NMR Spectra
n-Octyl β-D-glucopyranoside
  • Not Available
ThumbC14H28O6

292.3685 Da
292.18859 Da
1H NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
2-Methyl-1,4-napthoquinone
  • Not Available
ThumbC11H8O2

172.1800 Da
172.05243 Da
1H NMR Spectrum (1D, 600 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 600 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
7-Hydroxycoumarin
  • Not Available
ThumbC9H6O3

162.1440 Da
162.03169 Da
1H NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 101 MHz, C2D6OS, experimental)
13C NMR Spectrum (1D, 101 MHz, C2D6OS, experimental)
13C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
Versicomide G
  • Not Available
ThumbC19H25N3O4

359.4260 Da
359.18451 Da
1H NMR Spectrum (1D, 500, C2D6OS, simulated)
1H NMR Spectrum (1D, 501 MHz, C2D6OS, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 501 MHz, C2D6OS, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 501 MHz, C2D6OS, experimental)
13C NMR Spectrum (1D, 126 MHz, C2D6OS, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 501 MHz, C2D6OS, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 501 MHz, C2D6OS, experimental)
Aspergilpeptide A
  • Not Available
ThumbC36H36N4O6

620.7060 Da
620.26348 Da
1H NMR Spectrum (1D, 500, CD3OD, simulated)
13C NMR Spectrum (1D, 126 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 501 MHz, CD3OD, experimental)
7-methoxydehydrocyclopeptin
  • Not Available
ThumbC18H16N2O3

308.3370 Da
308.11609 Da
1H NMR Spectrum (1D, 500, CD3OD, simulated)
1H NMR Spectrum (1D, 501 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 126 MHz, CD3OD, experimental)
Versicomide H
  • Not Available
ThumbC19H23N3O3

341.4110 Da
341.17394 Da
1H NMR Spectrum (1D, 500, CDCl3, simulated)
13C NMR Spectrum (1D, 126 MHz, CDCl3, experimental)
1H NMR Spectrum (1D, 501 MHz, CDCl3, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 501 MHz, CDCl3, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 501 MHz, CDCl3, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 501 MHz, CDCl3, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 501 MHz, CDCl3, experimental)
Penicopeptide A
  • Not Available
ThumbC34H32N4O4

560.6540 Da
560.24236 Da
1H NMR Spectrum (1D, 500, CD3OD, simulated)
13C NMR Spectrum (1D, 126 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 501 MHz, CD3OD, experimental)
12β-O-acetyltenacigenin D
  • Not Available
ThumbC23H32O6

404.5030 Da
404.21989 Da
1H NMR Spectrum (1D, 400 MHz, CD3OD, simulated)
13C NMR Spectrum (1D, 101 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 400, CD3OD, simulated)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 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 ]-COSY 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)
(3S,8S,9S,10R,11S,12S,13S,14R,17S)-11α,12β-acetonide-17β-marsdenin
  • Not Available
ThumbC24H36O6

420.5460 Da
420.25119 Da
1H NMR Spectrum (1D, 400 MHz, C5D5N, simulated)
1H NMR Spectrum (1D, 400 MHz, C5D5N, simulated)
13C NMR Spectrum (1D, 101 MHz, C5D5N, simulated)
1H NMR Spectrum (1D, 400 MHz, C5D5N, simulated)
1H NMR Spectrum (1D, 400 MHz, C5D5N, simulated)
1H NMR Spectrum (1D, 400, C5D5deposition_typeN, simulated)
1H NMR Spectrum (1D, 401 MHz, C5D5N, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 401 MHz, C5D5N, experimental)
1H NMR Spectrum (1D, 401 MHz, C5D5N, experimental)
13C NMR Spectrum (1D, 101 MHz, C5D5N, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, C5D5N, experimental)
1H NMR Spectrum (1D, 401 MHz, C5D5N, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, C5D5N, experimental)
1H NMR Spectrum (1D, 401 MHz, C5D5N, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, C5D5N, experimental)
13C NMR Spectrum (1D, 101 MHz, C5D5N, experimental)
(3S,5S,8R,9S,10S,12S,13S,14R,17R,20R)-12β-O-4-hydroxyphenylacetyltenacigenin A
  • Not Available
ThumbC29H38O7

498.6160 Da
498.26175 Da
1H NMR Spectrum (1D, 400 MHz, CD3OD, simulated)
13C NMR Spectrum (1D, 101 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 400 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 400, CD3OD, simulated)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-COSY 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)
Tenacigenin D
  • Not Available
ThumbC21H30O5

362.4660 Da
362.20932 Da
1H NMR Spectrum (1D, 400 MHz, CD3OD, simulated)
13C NMR Spectrum (1D, 101 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 400 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 400, CD3OD, simulated)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-COSY 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)
12β-O-4-hydroxyphenylacetyltenacigenin D
  • Not Available
ThumbC29H36O7

496.6000 Da
496.24610 Da
1H NMR Spectrum (1D, 400 MHz, C5D5N, simulated)
13C NMR Spectrum (1D, 101 MHz, C5D5N, simulated)
1H NMR Spectrum (1D, 400 MHz, C5D5N, simulated)
1H NMR Spectrum (1D, 400, C5D5deposition_typeN, simulated)
1H NMR Spectrum (1D, 401 MHz, C5D5N, experimental)
13C NMR Spectrum (1D, 101 MHz, C5D5N, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, C5D5N, experimental)
1H NMR Spectrum (1D, 401 MHz, C5D5N, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, C5D5N, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, C5D5N, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 401 MHz, C5D5N, experimental)
13C NMR Spectrum (1D, 101 MHz, C5D5N, experimental)
12β-O-2-methylbutyryltenacigenin D
  • Not Available
ThumbC26H38O6

446.5840 Da
446.26684 Da
1H NMR Spectrum (1D, 400 MHz, CDCl3, simulated)
13C NMR Spectrum (1D, 101 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 400, CDCl3, simulated)
1H NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
(3S,5S,8R,9S,10S,12S,13S,14R,17R,20R)-12β-O-phenylacetyltenacigenin A
  • Not Available
ThumbC29H38O6

482.6170 Da
482.26684 Da
1H NMR Spectrum (1D, 400 MHz, CDCl3, simulated)
13C NMR Spectrum (1D, 101 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 400, CDCl3, simulated)
1H NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
12β-O-benzoyltenacigenin D
  • Not Available
ThumbC28H34O6

466.5740 Da
466.23554 Da
1H NMR Spectrum (1D, 400 MHz, CDCl3, simulated)
13C NMR Spectrum (1D, 101 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 400 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 400, CDCl3, simulated)
1H NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
1H NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
(3S,8S,9S,10R,11S,12S,13S,14R,17R,20R)-11α-O-benzoyl-17α-marsectohexol
  • Not Available
ThumbC28H38O7

486.6050 Da
486.26175 Da
1H NMR Spectrum (1D, 400 MHz, CD3OD, simulated)
13C NMR Spectrum (1D, 101 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 400 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 400, CD3OD, simulated)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
(3S,8S,9S,10R,11S,12S,13S,14R,17R,20R)-11α-O-tigloyl-17α-marsectohexol
  • Not Available
ThumbC26H40O7

464.5990 Da
464.27740 Da
1H NMR Spectrum (1D, 400 MHz, CD3OD, simulated)
13C NMR Spectrum (1D, 101 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 400 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 400, CD3OD, simulated)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-COSY 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)
Δ5-3β,8β,11α,14α-tetrahydroxy-12β-O-benzoylpregnane
  • Not Available
ThumbC28H36O7

484.5890 Da
484.24610 Da
1H NMR Spectrum (1D, 400 MHz, CD3OD, simulated)
13C NMR Spectrum (1D, 101 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 400 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 400, CD3OD, simulated)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-COSY 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)
12β-O-tigloyltenacigenin D
  • Not Available
ThumbC26H36O6

444.5680 Da
444.25119 Da
1H NMR Spectrum (1D, 400 MHz, CDCl3, simulated)
13C NMR Spectrum (1D, 101 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 400, CDCl3, simulated)
1H NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
(3S,8S,9S,10R,11S,12S,13S,14R,17S)-Δ5-3β,8β,14β-trihydroxy-11α-O-tigloyl-12β-O-benzoylpregnane
  • Not Available
ThumbC33H42O8

566.6910 Da
566.28797 Da
1H NMR Spectrum (1D, 400 MHz, CDCl3, simulated)
13C NMR Spectrum (1D, 101 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 400 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
1H NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
Tenaciside O
  • Not Available
ThumbC44H62O14

814.9660 Da
814.41396 Da
1H NMR Spectrum (1D, 400 MHz, CDCl3, simulated)
13C NMR Spectrum (1D, 101 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
13C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
Tenaciside N
  • Not Available
ThumbC47H64O14

853.0150 Da
852.42961 Da
1H NMR Spectrum (1D, 400 MHz, CD3OD, simulated)
13C NMR Spectrum (1D, 101 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 400 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 400, CD3OD, simulated)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
1H NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 401 MHz, CD3OD, experimental)
Tenaciside P
  • Not Available
ThumbC44H60O14

812.9500 Da
812.39831 Da
1H NMR Spectrum (1D, 600 MHz, CD3OD, simulated)
13C NMR Spectrum (1D, 151 MHz, CD3OD, simulated)
1H NMR Spectrum (1D, 600, CD3OD, simulated)
1H NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 151 MHz, CD3OD, experimental)
[1H , 13C ]-HSQC NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
[1H , 13C ]-HMBC NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
[1H , 1H ]-COSY NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
[1H , 1H ]-NOESY NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
13C NMR Spectrum (1D, 151 MHz, CD3OD, experimental)
5,7,30 ,40 -tetrahydroxy-6,8-diprenylisoflavone
  • Not Available
ThumbC25H26O6

422.4770 Da
422.17294 Da
1H NMR Spectrum (1D, 500 MHz, C3D6O, experimental)
Displaying natural products 1226 - 1250 of 281838 in total