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

NP0351298

(+)-Aceatrovenetinone A

Not Available

C₂₂H₂₂O₇

398.4110 Da
398.13655 Da

¹H NMR Spectrum (1D, 399 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 100 MHz, CDCl3, experimental)

NP0351297

(+)-12-Hydroxyaceatrovenetinone B

Not Available

C₂₂H₂₂O₈

414.4100 Da
414.13147 Da

¹³C NMR Spectrum (1D, 126 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 800 MHz, CDCl3, experimental)

NP0351296

(+)-12-Hydroxyaceatrovenetinone A

Not Available

C₂₂H₂₂O₈

414.4100 Da
414.13147 Da

¹H NMR Spectrum (1D, 800 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 126 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)

NP0351295

(+)-Phenaceatrovenetinone C

Not Available

C₂₇H₂₄O₉

492.4800 Da
492.14203 Da

[¹H, ¹H] NMR Spectrum (2D, 500 MHz, C3D6O, experimental)
¹H NMR Spectrum (1D, 500 MHz, C3D6O, experimental)
¹³C NMR Spectrum (1D, 126 MHz, C3D6O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 126 MHz, C3D6O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 126 MHz, C3D6O, experimental)

NP0351294

(+)-Phenaceatrovenetinone B

Not Available

C₂₇H₂₄O₈

476.4810 Da
476.14712 Da

[¹H, ¹³C] NMR Spectrum (2D, 100 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 100 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 399 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 100 MHz, CDCl3, experimental)

NP0351293

(+)-Phenaceatrovenetinone A

Not Available

C₂₇H₂₄O₈

476.4810 Da
476.14712 Da

¹³C NMR Spectrum (1D, 100 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 100 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 100 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 399 MHz, CDCl3, experimental)

NP0351292

Asperaculene G

Not Available

C₁₅H₂₂O₄

266.3370 Da
266.15181 Da

¹³C NMR Spectrum (1D, 101 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)

NP0351291

Asperaculene E

Not Available

C₁₅H₂₂O₃

250.3380 Da
250.15689 Da

¹³C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 100 MHz, C3D6O, experimental)
¹H NMR Spectrum (1D, 399 MHz, C3D6O, experimental)
¹H NMR Spectrum (1D, 401 MHz, CDCl3, experimental)

NP0351290

Aculene D

Not Available

C₁₄H₂₀O₂

220.3120 Da
220.14633 Da

[¹H, ¹³C] NMR Spectrum (2D, 101 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 400 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 101 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 400 MHz, CDCl3, experimental)

NP0351289

Aculenamide D

Not Available

C₂₃H₃₁NO₆

417.5020 Da
417.21514 Da

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

NP0351288

Aculenamide C

Not Available

C₂₀H₂₇NO₄

345.4390 Da
345.19401 Da

[¹H, ¹³C] NMR Spectrum (2D, 101 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 401 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 401 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 101 MHz, CDCl3, experimental)

NP0351287

Aculenamide B

Not Available

C₂₁H₂₉NO₄

359.4660 Da
359.20966 Da

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

NP0351286

Aculenamide A

Not Available

C₂₁H₂₉NO₄

359.4660 Da
359.20966 Da

¹H NMR Spectrum (1D, 401 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 399 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 399 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 100 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 101 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 401 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 100 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 101 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 101 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 100 MHz, CDCl3, experimental)

NP0351278

germidine-β-N-oxide

Not Available

C₃₄H₅₃NO₁₁

651.7940 Da
651.36186 Da

¹H NMR Spectrum (1D, 600.0, CD₃OD, simulated)
¹³C NMR Spectrum (1D, 150.0, CD₃OD, simulated)
¹³C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)

NP0351277

15-(2-methylbutyroyl) germine-β-N-oxide

Not Available

C₃₂H₅₁NO₁₀

609.7570 Da
609.35130 Da

¹H NMR Spectrum (1D, 600.0, CD₃OD, simulated)
¹³C NMR Spectrum (1D, 150.0, CD₃OD, simulated)
¹³C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)

NP0351276

zygadenine-β-N-oxide

Not Available

C₂₇H₄₃NO₈

509.6400 Da
509.29887 Da

¹H NMR Spectrum (1D, 600.0, C2D6OS, simulated)
¹³C NMR Spectrum (1D, 150.0, C2D6OS, simulated)
¹H NMR Spectrum (1D, 400 MHz, C2D6OS, experimental)

NP0351275

15α-Hydroxyjervine

Not Available

C₂₇H₃₉NO₄

441.6120 Da
441.28791 Da

¹H NMR Spectrum (1D, 600.0, CD₃OD, simulated)
¹³C NMR Spectrum (1D, 150.0, CD₃OD, simulated)
¹³C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)

NP0351274

Andrognathanol D

Not Available

C₂₃H₃₇NO₅

407.5510 Da
407.26717 Da

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

NP0351273

Andrognathanol C

Not Available

C₂₃H₃₇NO₅

407.5510 Da
407.26717 Da

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

NP0351272

Andrognathanol B

Not Available

C₂₃H₃₇NO₆

423.5500 Da
423.26209 Da

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

NP0351271

Andrognathanol A

Not Available

C₂₂H₃₅NO₆

409.5230 Da
409.24644 Da

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

NP0351270

Andrognathine F

Not Available

C₂₁H₃₅NO₄

365.5140 Da
365.25661 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)

NP0351269

Andrognathine E

Not Available

C₂₁H₃₅NO₄

365.5140 Da
365.25661 Da

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

NP0351268

Andrognathine D

Not Available

C₂₃H₃₉NO₄

393.5680 Da
393.28791 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)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)

NP0351267

Andrognathine C

Not Available

C₂₂H₃₇NO₄

379.5410 Da
379.27226 Da

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

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