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

NP0351134

bletistroside P

Not Available

C₄₉H₆₂O₂₃

1019.0120 Da
1018.36819 Da

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

NP0351133

Wikstdaphnoid G

Not Available

C₃₀H₄₆O₉

550.6890 Da
550.31418 Da

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

NP0351132

Wikstdaphnoid E

Not Available

C₃₀H₄₄O₁₀

564.6720 Da
564.29345 Da

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

NP0351131

Wikstdaphnoid H

Not Available

C₃₇H₄₈O₁₀

652.7810 Da
652.32475 Da

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

NP0351130

sonnerachromone G

Not Available

C₂₁H₂₈O₁₁

456.4440 Da
456.16316 Da

¹H NMR Spectrum (1D, 500 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 126 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 126 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)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)

NP0351129

sonnerachromone A

Not Available

C₁₅H₁₄O₉

338.2680 Da
338.06378 Da

¹³C NMR Spectrum (1D, 126 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 126 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 500 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 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)

NP0351128

Inornatoside B

Not Available

C₅₆H₈₉NaO₂₈S

1265.3500 Da
1264.51588 Da

¹H NMR Spectrum (1D, 700 MHz, C5D5N, experimental)
[¹H, ¹H] NMR Spectrum (2D, 700 MHz, C5D5N, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 700 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 176 MHz, C5D5N, experimental)

NP0351127

22R-Holothurin B

Not Available

C₄₁H₆₃NaO₁₇S

882.9900 Da
882.36837 Da

¹³C NMR Spectrum (1D, 176 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 700 MHz, C5D5N, experimental)
[¹H, ¹H] NMR Spectrum (2D, 700 MHz, C5D5N, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 700 MHz, C5D5N, experimental)

NP0351126

Inornatoside E

Not Available

C₃₆H₅₁NaO₁₈S

826.8400 Da
826.26938 Da

¹³C NMR Spectrum (1D, 176 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 700 MHz, C5D5N, experimental)
[¹H, ¹H] NMR Spectrum (2D, 700 MHz, C5D5N, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 700 MHz, C5D5N, experimental)

NP0351125

Inornatoside D

Not Available

C₄₁H₆₁NaO₁₈S

896.9700 Da
896.34763 Da

¹H NMR Spectrum (1D, 700 MHz, C5D5N, experimental)
[¹H, ¹H] NMR Spectrum (2D, 700 MHz, C5D5N, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 700 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 176 MHz, C5D5N, experimental)

NP0351124

Inornatoside C

Not Available

C₄₁H₆₅NaO₁₇S

885.0000 Da
884.38402 Da

¹H NMR Spectrum (1D, 700 MHz, C5D5N, experimental)
[¹H, ¹H] NMR Spectrum (2D, 700 MHz, C5D5N, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 700 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 176 MHz, C5D5N, experimental)

NP0351123

Inornatoside A

Not Available

C₄₃H₆₇NaO₁₈S

927.0400 Da
926.39458 Da

[¹H, ¹³C] NMR Spectrum (2D, 700 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 700 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 176 MHz, C5D5N, experimental)
[¹H, ¹H] NMR Spectrum (2D, 700 MHz, C5D5N, experimental)

NP0351122

Coloratoside A

Not Available

C₅₅H₈₈O₂₇

1181.2820 Da
1180.55130 Da

[¹H, ¹H] NMR Spectrum (2D, 700 MHz, C5D5N, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 700 MHz, C5D5N, experimental)
¹³C NMR Spectrum (1D, 700 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 700 MHz, C5D5N, experimental)

NP0351121

arthrichitin K

Not Available

C₃₄H₅₀N₄O₈

642.7940 Da
642.36286 Da

¹H NMR Spectrum (1D, 500 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 126 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 126 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)

NP0351120

arthrichitin J

Not Available

C₃₄H₄₈N₄O₁₀

672.7760 Da
672.33704 Da

¹³C NMR Spectrum (1D, 126 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 126 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 500 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)

NP0351119

1′(αS), 4′(αR)-2′,3′-dihydroprotoapigenin-4’-O-β-D-glucoside

Not Available

C₂₁H₂₄O₁₁

452.4120 Da
452.13186 Da

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

NP0351118

1'S-2',3'-dihydroprotoapigenone

Not Available

C₁₅H₁₂O₆

288.2550 Da
288.06339 Da

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

NP0351117

bletistroside X

Not Available

C₂₂H₂₂O₃

334.4150 Da
334.15689 Da

¹H NMR Spectrum (1D, 400 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 400 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 400 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 400 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)

NP0351116

bletistroside V

Not Available

C₂₂H₂₄O₉

432.4250 Da
432.14203 Da

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)

NP0351115

bletistroside U

Not Available

C₃₃H₃₈O₁₄

658.6530 Da
658.22616 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, 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)

NP0351114

bletistroside T

Not Available

C₃₃H₃₈O₁₄

658.6530 Da
658.22616 Da

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

NP0351113

bletistroside S

Not Available

C₃₃H₃₈O₁₄

658.6530 Da
658.22616 Da

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)

NP0351112

bletistroside R

Not Available

C₃₃H₃₈O₁₄

658.6530 Da
658.22616 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, 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)

NP0351111

bletistroside Q

Not Available

C₄₃H₅₀O₁₇

838.8560 Da
838.30480 Da

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

NP0351110

bletistroside O

Not Available

C₅₁H₆₄O₂₄

1061.0490 Da
1060.37875 Da

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

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