ID |
|
|
|
|
|
|
|
|
|
|
|
|
Parent - B1a [M+NH4]+ |
C48H74O14 |
874.5083 |
892.5421 |
1 |
0.5 |
13.94 |
1.03E+07 |
64.8 |
93.7 |
HLM |
|
Parent - B1b [M+NH4]+ |
C47H72O14 |
860.492 |
878.5258 |
1 |
-0.3 |
13.03 |
1.33E+05 |
3.5 |
90 |
HLM |
M1 |
Loss of CH2 [M+NH4]+ |
C47H72O14 |
860.4922 |
878.526 |
1 |
0 |
12.58 |
6.07E+05 |
3.8 |
86.6 |
HLM, PHH, Blood |
M2 |
Loss of C7H12O3 [M+NH4]+ |
C41H62O11 |
730.4283 |
748.4621 |
1 |
-1.2 |
12.33 |
2.76E+04 |
0.2 |
81.7 |
HLM |
M3 |
Oxidation [M+NH4]+ |
C48H74O15 |
890.5033 |
908.5371 |
1 |
0.6 |
11.67 |
9.03E+05 |
5.7 |
78.9 |
HLM, PHH, Blood |
M4 |
Ketone Formation [M+NH4]+ |
C48H72O15 |
888.4862 |
906.5201 |
1 |
-1 |
11.17 |
6.42E+04 |
0.4 |
69.7 |
HLM |
M5 |
Oxidation [M+NH4]+ |
C48H74O15 |
890.503 |
908.5368 |
1 |
0.2 |
10.72 |
2.96E+05 |
1.9 |
68.7 |
HLM, PHH |
M6 |
Demethylation and Oxidation [M+NH4]+ |
C47H72O15 |
876.4868 |
894.5206 |
1 |
-0.4 |
10.48 |
1.63E+05 |
1 |
76.5 |
HLM, PHH,
Blood |
M7 |
Demethylation and Methylene to Ketone [M+NH4]+ |
C47H70O15 |
874.4708 |
892.5046 |
1 |
-0.8 |
10.15 |
2.20E+04 |
0.1 |
67 |
HLM |
M8 |
Demethylation to Carboxylic Acid [M+NH4]+ |
C48H72O16 |
904.4808 |
922.5146 |
1 |
-1.3 |
9.92 |
1.81E+04 |
0.1 |
66.7 |
HLM |
M9 |
Demethylation and Oxidation [M+NH4]+ |
C47H72O15 |
876.487 |
894.5208 |
1 |
-0.2 |
9.69 |
9.56E+04 |
0.6 |
71.7 |
HLM |
M10 |
Demethylation to Carboxylic Acid [M+NH4]+ |
C48H72O16 |
904.4819 |
922.5157 |
1 |
-0.1 |
9.57 |
1.34E+04 |
0.1 |
66.7 |
HLM |
M11 |
Loss of C7H12O3+Oxidation [M+NH4]+ |
C41H62O12 |
746.4225 |
764.4563 |
1 |
-2.2 |
9.48 |
1.36E+04 |
0.1 |
67.3 |
HLM |
M12 |
Di-Oxidation [M+NH4]+ |
C48H74O16 |
906.4976 |
924.5314 |
1 |
-0.1 |
9.22 |
4.89E+04 |
0.3 |
68.4 |
HLM |
M13 |
Oxidation [M+NH4]+ |
C48H74O15 |
890.5027 |
908.5365 |
1 |
-0.1 |
8.4 |
2.86E+04 |
0.2 |
73.7 |
HLM |