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

NP0331211

Trachycladindole J

Not Available

C₁₄H₁₃BrN₄O₂

349.1880 Da
348.02219 Da

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

NP0331212

JIA-X21

Not Available

C₂₀H₂₀N₂O₄

352.3900 Da
352.14231 Da

¹³C NMR Spectrum (1D, 151 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 176 MHz, CD3OD, experimental)
¹H NMR Spectrum (1D, 600 MHz, D2O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 700 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 700 MHz, CD3OD, experimental)

NP0331213

Desferricoprogen

Not Available

C₃₅H₅₆N₆O₁₃

768.8620 Da
768.39054 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, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)

NP0331214

Dimerumic acid

Not Available

C₂₂H₃₆N₄O₈

484.5500 Da
484.25331 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, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)

NP0331216

Prunolide E

Not Available

C₃₄H₂₁BrO₉

653.4370 Da
652.03690 Da

¹H NMR Spectrum (1D, 500 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 126 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)

NP0331217

Prunolide I

Not Available

C₃₄H₂₀Br₂O₉

732.3330 Da
729.94741 Da

¹H NMR Spectrum (1D, 500 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 800 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 800 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 800 MHz, CD3OD, experimental)

NP0331218

Prunolide F

Not Available

C₃₄H₁₉Br₃O₉

811.2290 Da
807.85792 Da

¹³C NMR Spectrum (1D, 126 MHz, CD3OD, experimental)
¹H NMR Spectrum (1D, 500 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)

NP0331219

Prunolide H

Not Available

C₃₄H₁₈Br₄O₉

890.1250 Da
885.76843 Da

[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 201 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 500 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)

NP0331220

Prunolide D

Not Available

C₃₄H₂₁BrO₉

653.4370 Da
652.03690 Da

¹H NMR Spectrum (1D, 500 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 126 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)

NP0331221

cis-Prunolide C

Not Available

C₃₄H₂₂O₉

574.5410 Da
574.12638 Da

¹H NMR Spectrum (1D, 800 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 800 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 201 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 800 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 800 MHz, C2D6OS, experimental)

NP0331222

Prunolide G

Not Available

C₃₄H₁₇Br₅O₉

969.0210 Da
963.67895 Da

¹H NMR Spectrum (1D, 500 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 126 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)

NP0331223

Astramalabaricoside M

Not Available

C₅₄H₉₀O₂₆

1155.2880 Da
1154.57203 Da

¹H NMR Spectrum (1D, 300 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 300 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)

NP0331224

Astramalabaricoside Q

Not Available

C₆₁H₁₀₁NO₃₀

1328.4560 Da
1327.64084 Da

¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)

NP0331225

Astramalabaricoside N

Not Available

C₆₂H₁₀₃NO₃₁

1358.4820 Da
1357.65141 Da

¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)

NP0331226

Astramalabaricoside T

Not Available

C₅₆H₉₃NO₂₅

1180.3420 Da
1179.60367 Da

¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)

NP0331227

Astramalabaricoside L

Not Available

C₆₆H₁₁₃NO₃₄

1464.6030 Da
1463.71440 Da

¹H NMR Spectrum (1D, 300 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 300 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)

NP0331228

Astramalabaricoside F

Not Available

C₄₇H₈₂O₂₀

967.1530 Da
966.53995 Da

¹H NMR Spectrum (1D, 300 MHz, D2O, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 300 MHz, D2O, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)

NP0331229

Astramalabaricoside R

Not Available

C₅₈H₉₅NO₂₇

1238.3780 Da
1237.60915 Da

¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)

NP0331230

Astramalabaricoside S

Not Available

C₅₈H₉₅NO₂₇

1238.3780 Da
1237.60915 Da

¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)

NP0331231

Astramalabaricoside G

Not Available

C₅₅H₉₅NO₂₅

1170.3470 Da
1169.61932 Da

¹H NMR Spectrum (1D, 400 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)
¹H NMR Spectrum (1D, 400 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)

NP0331232

Astramalabaricoside P

Not Available

C₅₆H₉₃NO₂₆

1196.3410 Da
1195.59858 Da

¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)

NP0331233

Astramalabaricoside E

Not Available

C₅₀H₈₇NO₂₁

1038.2320 Da
1037.57706 Da

¹H NMR Spectrum (1D, 300 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 300 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)

NP0331234

Astramalabaricoside K

Not Available

C₆₁H₁₀₅NO₃₀

1332.4880 Da
1331.67214 Da

¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)

NP0331235

Astramalabaricoside B

Not Available

C₅₅H₉₅NO₂₄

1154.3480 Da
1153.62440 Da

¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)

NP0331236

Astramalabaricoside C

Not Available

C₆₀H₁₀₃NO₂₈

1286.4630 Da
1285.66666 Da

¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)

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