1. Statistics of records of ReSpect (September 2011)
A. Literature data |
Total |
3,341 |
records |
|
corresponding to 2,741 metabolites
|
Data type ![[Help]](/menta.cgi/static/respect/images/iconHelp.gif) |
Adjusted data |
1,767 |
records |
|
Single fragment spectra |
509 |
records |
|
One major fragment spectra |
145 |
records |
|
Polarity |
Positive |
1,512 |
records |
|
Negative |
1,829 |
records |
|
B. Q-TOF/MS data |
Total |
1,050 |
records |
|
corresponding to 575 standard compounds
|
Data type ![[Help]](/menta.cgi/static/respect/images/iconHelp.gif) |
Single fragment spectra |
22 |
records |
|
One major fragment spectra |
110 |
records |
|
Polarity |
Positive |
523 |
records |
|
Negative |
527 |
records |
|
C. QqQ/MS data |
Total |
4,258 |
records |
|
corresponding to 861 standard compounds
|
Data type ![[Help]](/menta.cgi/static/respect/images/iconHelp.gif) |
Single fragment spectra |
162 |
records |
|
One major fragment spectra |
274 |
records |
|
Polarity |
Positive |
2,901 |
records |
|
Negative |
1,357 |
records |
|
D. All data |
Total |
8,649 |
records |
|
corresponding to 3,595 metabolites
|
Data type ![[Help]](/menta.cgi/static/respect/images/iconHelp.gif) |
Single fragment spectra |
693 |
records |
|
One major fragment spectra |
529 |
records |
|
Polarity |
Positive |
4,936 |
records |
|
Negative |
3,713 |
records |
|
Table. Number of records in compound class 1
Compound class 1 |
A. Literature data |
B. Q-TOF/MS data |
C. QqQ/MS data |
D. All data |
Total |
3,341 |
1,050 |
4,258 |
8,649 |
Alkaloid |
251 |
42 |
111 |
404 |
Amino acid |
165 |
180 |
519 |
864 |
Flavonoid |
1,407 |
284 |
1,266 |
2,957 |
Glucosinolate |
117 |
18 |
86 |
221 |
Phenylpropanoid |
341 |
45 |
159 |
545 |
Stilbenoid |
20 |
3 |
20 |
43 |
Tannin |
128 |
5 |
15 |
148 |
Terpenoid |
590 |
20 |
105 |
715 |
Other |
322 |
453 |
1,977 |
2,752 |
Table. Ratio of records in compound class 1
Compound class 1 |
A. Literature data (%) |
B. Q-TOF/MS data (%) |
C. QqQ/MS data (%) |
D. All data (%) |
Total |
100 |
100 |
100 |
100 |
Alkaloid |
8 |
4 |
3 |
5 |
Amino acid |
5 |
17 |
12 |
10 |
Flavonoid |
42 |
27 |
30 |
34 |
Glucosinolate |
4 |
2 |
2 |
3 |
Phenylpropanoid |
10 |
4 |
4 |
6 |
Stilbenoid |
1 |
0 |
0 |
0 |
Tannin |
4 |
0 |
0 |
2 |
Terpenoid |
18 |
2 |
2 |
8 |
Other |
10 |
43 |
46 |
32 |
Adjusted data: |
Single fragment spectra: |
One major peak spectra: |
 |
 |
 |
Single fragment spectra: |
One major peak spectra: |
 |
 |