Table 1 List of ions identified based on the contribution of each ion to the variance of the observations and their reliability.
Milk type | Mass bin [m/z] | S-plot p[1] value | S-plot p(corr) value | Representative mass [m/z] | Accurate mass [m/z] | Formula | Lipid identifier | LM ID |
|---|---|---|---|---|---|---|---|---|
Cow milk | 537.3 | −0.066 | −0.854 | 537.3516 | 537.3551 | C27H53O8P | PA(24:0) | LMGP10010030 |
565.3 | −0.070 | −0.853 | 565.3904 | 565.3864 | C29H57O8P | PA(26:0) | LMGP10010933 | |
577.5 | −0.055 | −0.836 | 577.4272 | 577.4228 | C31H61O7P | PA(P-28:0) | LMGP10030001 | |
593.5 | −0.086 | −0.898 | 593.4140 | 593.4177 | C31H61O8P | PA(28:0) | LMGP10010944 | |
605.5 | −0.061 | −0.892 | 605.4564 | 605.4541 | C33H65O7P | PA(P-30:0) | LMGP10030003 | |
619.5 | −0.068 | −0.903 | 619.4680 | 619.4697 | C34H67O7P | PA(P-31:0) | LMGP10030005 | |
621.5 | −0.103 | −0.895 | 621.4513 | 621.4490 | C33H65O8P | PA(30:0) | LMGP10010943 | |
628.5 | −0.065 | −0.656 | 628.5848 | 628.5874 | C38H77NO5 | Cer(38:0;O4) | LMSP02030017 | |
633.5 | −0.075 | −0.854 | 633.4876 | 633.4854 | C35H69O7P | PA(P-32:0) | LMGP10030007 | |
647.5 | −0.082 | −0.915 | 647.5047 | 647.5010 | C36H71O7P | PA(P-33:0) | LMGP10030009 | |
656.5 | −0.054 | −0.621 | 656.5998 | 656.6187 | C40H81NO5 | Cer(40:0;O4) | LMSP02030018 | |
661.5 | −0.073 | −0.779 | 661.5192 | 661.5167 | C37H73O7P | PA(P-34:0) | LMGP10030012 | |
677.5 | −0.122 | −0.803 | 677.5127 | 677.5116 | C37H73O8P | PA(34:0) | LMGP10010940 | |
687.5 | −0.061 | −0.793 | 687.5358 | 687.5323 | C39H75O7P | PA(P-36:1) | LMGP10030019 | |
703.5 | −0.114 | −0.835 | 703.5297 | 703.5272 | C39H75O8P | PA(36:1) | LMGP10010214 | |
731.5 | −0.066 | −0.705 | 731.5517 | 731.5585 | C41H79O8P | PA(38:1) | LMGP10010220 | |
1146.5 | −0.057 | −0.840 | 1146.5184 | 1146.5087 | C47H86N7O17P3S | CoA(26:0) | LMFA07050327 | |
1174.5 | −0.052 | −0.844 | 1174.5574 | 1174.5400 | C49H90N7O17P3S | CoA(28:0) | LMFA07050351 | |
1202.7 | −0.059 | −0.856 | 1202.6506 | 1202.6211 | C52H101NO25P2 | M(IP)2C(34:0;O3) | LMSP03030108 | |
1232.7 | −0.061 | −0.845 | 1230.6704 | 1230.6524 | C54H105NO25P2 | M(IP)2C(36:0;O3) | LMSP03030109 | |
1286.7 | −0.058 | −0.875 | 1286.7344 | 1286.7150 | C58H113NO25P2 | M(IP)2C(40:0;O3) | LMSP03030111 | |
1314.7 | −0.065 | −0.854 | 1314.7518 | 1314.7463 | C60H117NO25P2 | M(IP)2C(42:0;O3) | LMSP03030112 | |
1342.7 | −0.059 | −0.807 | 1342.7896 | 1342.7776 | C62H121NO25P2 | M(IP)2C(44:0;O3) | LMSP03030113 | |
Oat milk | 872.7 | 0.056 | 0.711 | 872.7094 | 872.7103 | C50H98NO8P | PC(42:1) | LMGP01012161 |
903.7 | 0.072 | 0.544 | 903.7435 | 903.7436 | C59H98O6 | TG(56:8) | LMGL03016229 | |
Oat milk Soya milk | 917.7 | 0.136 | 0.671 | 917.7568 | 917.7593 | C60H100O6 | TG(57:8) | LMGL03016407 |
Soya milk | 893.7 | 0.095 | 0.692 | 893.7489 | 893.7593 | C58H100O6 | TG(55:6) | LMGL03015620 |
Camel milk | 881.7 | 0.050 | 0.654 | 881.7578 | 881.7593 | C57H100O6 | TG(54:5) | LMGL03010352 |
