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

NP0333182

(5S,8R,9R,10S)-2S-Acetoxy-6S-hydroxyclerod-3,12,14-trien-18,19-dial

Not Available

C₂₂H₃₀O₅

374.4770 Da
374.20932 Da

[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)

NP0333183

Graveospene H

Not Available

C₂₅H₃₆O₇

448.5560 Da
448.24610 Da

[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)

NP0333184

Corymbotin D

Not Available

C₂₆H₃₆O₈

476.5660 Da
476.24102 Da

[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)

NP0333185

Corymbotin F

Not Available

C₂₈H₃₈O₈

502.6040 Da
502.25667 Da

¹H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 126 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)

NP0333186

(5S,8R,9R,10S)-2S-Acetoxy-6S-methoxyclerod-3,12,14-trien-18,19-dial

Not Available

C₂₃H₃₂O₅

388.5040 Da
388.22497 Da

[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)

NP0333187

(2R)-2-Methylpropenoyloxy-6S-hydroxy-18S-methoxy-19S-acetoxyzuelanin

Not Available

C₂₇H₃₈O₇

474.5940 Da
474.26175 Da

[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)

NP0333188

(2S,6S,18S,19S)-Tetraacetoxyzuelanin

Not Available

C₂₈H₃₈O₉

518.6030 Da
518.25158 Da

¹H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)

NP0333189

Corimbotin A

Not Available

C₂₇H₃₈O₈

490.5930 Da
490.25667 Da

[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)

NP0333190

(2R)-Propanoyloxy-(6R)-methoxy-18R,19S-diacetoxyzuelanin

Not Available

C₂₈H₄₀O₈

504.6200 Da
504.27232 Da

¹H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CDCl3, experimental)

NP0333191

Triculamin

Not Available

C₇₂H₁₂₉N₂₇O₂₁

1708.9920 Da
1707.98563 Da

[¹H, ¹³C] NMR Spectrum (2D, 950 MHz, D2O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 950 MHz, D2O, experimental)
[¹H, ¹⁵N] NMR Spectrum (2D, 950 MHz, D2O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 950 MHz, D2O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 950 MHz, D2O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 950 MHz, D2O, experimental)
¹H NMR Spectrum (1D, 950 MHz, D2O, experimental)
[¹H, ¹⁵N] NMR Spectrum (2D, 950 MHz, D2O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 950 MHz, D2O, experimental)
[¹H, ¹⁵N] NMR Spectrum (2D, 950 MHz, D2O, experimental)
[¹H, ¹⁵N] NMR Spectrum (2D, 950 MHz, D2O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 950 MHz, D2O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 950 MHz, D2O, experimental)
¹H NMR Spectrum (1D, 950 MHz, D2O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 950 MHz, D2O, experimental)
¹H NMR Spectrum (1D, 950 MHz, D2O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 950 MHz, D2O, experimental)
[¹H, ¹⁵N] NMR Spectrum (2D, 950 MHz, D2O, experimental)

NP0333192

Tufnelactone A

Not Available

C₃₈H₅₁NO₁₂

713.8210 Da
713.34113 Da

¹H NMR Spectrum (1D, 600 MHz, C3D6O, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C3D6O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
¹H NMR Spectrum (1D, 600 MHz, C3D6O, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C3D6O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
¹H NMR Spectrum (1D, 600 MHz, C3D6O, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C3D6O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
¹H NMR Spectrum (1D, 600 MHz, C3D6O, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C3D6O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)

NP0333193

Tufnelactone B

Not Available

C₃₈H₄₈O₁₂

696.7900 Da
696.31458 Da

¹H NMR Spectrum (1D, 600 MHz, C3D6O, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C3D6O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C3D6O, experimental)

NP0333194

Tufnelactone C

Not Available

C₂₈H₃₅NO₈

513.5870 Da
513.23627 Da

¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)

NP0333195

Tufnelactone D

Not Available

C₂₄H₃₅NO₈

465.5430 Da
465.23627 Da

¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)

NP0333196

Tufnelactone E

Not Available

C₂₅H₃₇NO₈

479.5700 Da
479.25192 Da

¹H NMR Spectrum (1D, 600 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 151 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)

NP0333197

Weizhouochrone B

Not Available

C₂₈H₃₂O₂

400.5620 Da
400.24023 Da

¹H NMR Spectrum (1D, simulated)
¹³C NMR Spectrum (1D, 126 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 126 MHz, CD3OD, experimental)
¹H NMR Spectrum (1D, 600 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)

NP0333201

Glenthamine A

Not Available

C₃₈H₃₉NO₁₃

717.7240 Da
717.24214 Da

[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)

NP0333202

Glenthimine A

Not Available

C₃₈H₃₇NO₁₃

715.7080 Da
715.22649 Da

¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)

NP0333203

Glenthol A

Not Available

C₁₆H₁₆O₆

304.2980 Da
304.09469 Da

¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C6D6, experimental)

NP0333204

Glenthol B

Not Available

C₁₆H₁₆O₆

304.2980 Da
304.09469 Da

¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C6D6, experimental)

NP0333205

Glenthamide A

Not Available

C₂₂H₂₃NO₉

445.4240 Da
445.13728 Da

¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)

NP0333206

Borrelidin B

Not Available

C₂₈H₄₇NO₆

493.6850 Da
493.34034 Da

¹H NMR Spectrum (1D, 600 MHz, CDCL3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C5D5N, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C5D5N, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)

NP0333227

7-Methoxycarviolin

Not Available

C₁₇H₁₄O₇

330.2920 Da
330.07395 Da

¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)

NP0333229

(±)-Neobulgarone E

Not Available

C₃₂H₂₄Cl₂O₈

607.4400 Da
606.08482 Da

¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)

NP0333231

(+)-Neobulgarone H

Not Available

C₃₃H₂₆Cl₂O₉

637.4600 Da
636.09539 Da

¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)

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