Clustering data with hclust algorithm for LCMS lipid and acyl-carnitine analysis (Study ST001332)
Reversed phase UNSPECIFIED ION MODE (Analysis AN002221)| Metabolite | Structure | F1 | F2 | F3 | F4 | F5 | F6 |
|---|---|---|---|---|---|---|---|
| Cer_(d18:1_18:1) | ME309701 | 0.47 | 4.81 | 0.36 | 0.18 | 0.27 | 0.18 |
| LPC_(22:5) | ME309740 | 1.07 | 0.55 | 0.51 | 1.54 | 0.11 | 2.06 |
| Carnitine_(C09) | ME309665 | 0.33 | 0.99 | 0.18 | 0.82 | NA | 2.56 |
| LPE_(16:0) | ME309735 | 1.14 | 0.94 | 0.54 | 0.69 | 0.15 | 2.38 |
| LPE_(18:2) | ME309726 | NA | NA | 1.48 | NA | 0.81 | 0.71 |
| LPE_(20:1) | ME309762 | NA | NA | 1.15 | NA | 0.46 | 1.08 |
| Cer_(d18:0_22:0) | ME309712 | 0.91 | 0.65 | 1.21 | 0.78 | 0.65 | 1.64 |
| LPE_(20:0) | ME309759 | 0.45 | 0.42 | 1.47 | 0.60 | 1.06 | 1.85 |
| Carnitine_(C12:1_OH) | ME309667 | 0.46 | 0.67 | 1.30 | 0.49 | 1.67 | 1.30 |
| LPE_(20:5) | ME309731 | 0.36 | 0.36 | 1.98 | 0.24 | 1.19 | 0.95 |
| Carnitine_(C05:1) | ME309653 | 0.84 | 1.00 | NA | 1.59 | 0.73 | 1.09 |
| Carnitine_(C05_OH) | ME309650 | 0.39 | 0.96 | NA | 1.31 | 1.63 | 1.63 |
| Carnitine_(C02) | ME309640 | 1.03 | 0.92 | 0.37 | 0.86 | 1.28 | 1.46 |
| Cer_(d18:0_26:1) | ME309716 | 0.92 | 0.74 | 0.74 | 0.74 | 1.23 | 1.48 |
| LPE_(19:0) | ME309756 | 0.59 | 1.03 | 1.22 | 1.32 | 1.17 | 0.93 |
| Cer_(d18:0_26:0) | ME309717 | 1.11 | 0.74 | 1.23 | 0.74 | 0.99 | 0.99 |
| Cer_(d18:0_20:0) | ME309709 | 0.83 | 0.88 | 1.24 | 1.07 | 0.91 | 1.11 |
| LPE_(22:0) | ME309761 | 0.84 | 1.06 | 1.30 | 1.24 | 0.71 | 1.00 |
| Cer_(d18:0_24:0) | ME309714 | 1.14 | 0.65 | 1.31 | 0.98 | 0.65 | 1.09 |
| Cer_(d18:0_24:1) | ME309713 | 1.12 | 1.00 | 1.25 | 1.00 | 0.67 | 1.00 |
| LPCO_(18:0) | ME309755 | 1.69 | 0.48 | 1.15 | 1.07 | 0.58 | 0.64 |
| LPC_(17:0) | ME309742 | 1.50 | 0.79 | 1.07 | 1.69 | 0.48 | 0.46 |
| LPC_(20:4) | ME309746 | 1.44 | 0.72 | 1.12 | 1.47 | 0.66 | 0.50 |
| LPC_(18:2) | ME309719 | 0.81 | 0.78 | 1.63 | 1.61 | 0.64 | 0.72 |
| LPC_(18:3) | ME309734 | 0.76 | 1.00 | 1.61 | 1.58 | 0.66 | 0.66 |
| LPC_(16:0) | ME309733 | 1.21 | 1.13 | 1.40 | 1.61 | 0.44 | 0.39 |
| LPC_(15:0) | ME309732 | 1.02 | 0.97 | 1.44 | 1.59 | 0.52 | 0.63 |
| LPC_(20:3) | ME309745 | 1.03 | 0.98 | 1.36 | 1.76 | 0.58 | 0.53 |
| LPC_(20:5) | ME309720 | 0.80 | 0.74 | 1.23 | 1.82 | 0.47 | 1.19 |
| Carnitine_(C17) | ME309692 | 1.14 | 0.97 | 0.85 | 1.90 | 0.59 | 0.79 |
| Carnitine_(C18) | ME309693 | 0.77 | 1.05 | 1.16 | 1.80 | 0.58 | 0.78 |
| Carnitine_(C18:1) | ME309691 | 1.88 | 0.32 | 0.45 | 0.65 | 1.05 | 0.83 |
| Cer_(d18:0_22:1) | ME309710 | 1.32 | 0.86 | 0.86 | 0.99 | 0.49 | 1.31 |
| Cer_(d18:1_22:1) | ME309707 | 1.57 | 0.67 | 0.87 | 0.81 | 0.65 | 1.07 |
| Cer_(d18:0_18:1) | ME309703 | 1.79 | 0.55 | 0.83 | 0.55 | 0.74 | 0.92 |
| Cer_(d18:0_20:1) | ME309708 | 1.60 | 0.73 | 0.75 | 0.77 | 0.87 | 0.92 |
| LPE_(18:1) | ME309739 | 1.68 | 0.67 | 0.88 | 0.70 | 0.88 | 0.75 |
| Cer_(d18:1_24:1) | ME309711 | 1.45 | 0.95 | 0.99 | 1.00 | 0.47 | 0.97 |
| Cer_(d18:1_20:1) | ME309706 | 1.61 | 0.82 | 0.79 | 0.99 | 0.70 | 0.82 |
| Cer_(d18:1_26:1) | ME309715 | 1.56 | 0.95 | 0.79 | 0.98 | 0.71 | 0.80 |
| Cer_(d18:1_24:2) | ME309704 | 1.00 | NA | 1.00 | NA | 1.00 | 1.00 |
| LPC_(16:1) | ME309723 | 1.58 | 0.28 | 1.29 | 0.41 | 1.03 | 0.78 |
| LPC_(18:1) | ME309737 | 1.44 | 0.37 | 1.19 | 0.61 | 1.16 | 0.74 |
| Carnitine_(C0) | ME309638 | 0.43 | 0.67 | 2.47 | 0.94 | 0.84 | 0.72 |
| Carnitine_(C03_OH) | ME309645 | NA | 0.69 | 1.87 | 0.87 | NA | NA |
| LPE_(17:1) | ME309728 | 0.61 | 2.44 | 1.16 | 1.88 | 0.19 | 0.63 |
| LPC_(14:0) | ME309722 | NA | 1.22 | 1.62 | 1.69 | 0.32 | 0.46 |
| LPC_(17:1) | ME309724 | 0.66 | 1.24 | 1.78 | 1.94 | 0.17 | 0.72 |
| LPEO_(19:0) | ME309760 | 1.55 | 0.36 | NA | 0.55 | NA | NA |
| LPE_(16:1) | ME309727 | 2.53 | 0.21 | 0.41 | NA | 0.28 | 0.34 |
| LPE_(21:1) | ME309763 | 2.58 | 0.52 | 0.52 | 0.78 | 0.17 | 0.65 |
| Carnitine_(C12:1) | ME309671 | 2.18 | 0.66 | 0.38 | 0.64 | 0.51 | 0.38 |
| LPC_(22:4) | ME309747 | 2.38 | 0.55 | 0.38 | 1.10 | 0.58 | 0.22 |
| Carnitine_(C12_OH) | ME309669 | 0.21 | 2.16 | NA | 0.63 | NA | NA |
| Carnitine_(C14_OH) | ME309675 | 0.35 | 2.11 | NA | 1.20 | NA | NA |
| Carnitine_(C16_OH) | ME309682 | 0.18 | 1.75 | NA | 1.47 | NA | NA |
| Carnitine_(C18:1_OH) | ME309681 | 0.72 | 0.45 | NA | 2.12 | NA | NA |
| LPE_(22:6) | ME309743 | 0.42 | 0.83 | NA | 1.46 | NA | NA |
| Cer_(d18:0_17:0) | ME309702 | 1.00 | 1.00 | 1.00 | 1.00 | NA | NA |
| Carnitine_(C11) | ME309672 | 0.88 | 1.29 | NA | 1.60 | NA | 0.57 |
| Carnitine_(C06_dicarboxylic_acid) | ME309655 | 1.17 | 1.09 | NA | 0.56 | NA | NA |
| Carnitine_(C10_OH) | ME309662 | 1.04 | 1.34 | NA | 0.57 | NA | NA |
| Carnitine_(C16:2) | ME309680 | 1.18 | 0.80 | NA | 1.11 | NA | 0.45 |
| Carnitine_(C19) | ME309694 | 1.14 | 0.72 | NA | 1.00 | NA | NA |
| LPC_(19:0) | ME309754 | 1.09 | 0.62 | NA | 1.20 | NA | NA |
| Carnitine_(C12) | ME309676 | 0.75 | 1.28 | 0.44 | 1.49 | NA | NA |
| Carnitine_(C16) | ME309690 | 0.71 | 1.19 | NA | 1.40 | NA | NA |
| Carnitine_(C20) | ME309695 | 0.81 | 0.98 | NA | 1.40 | NA | NA |
| Carnitine_(C10) | ME309668 | 1.01 | 1.00 | NA | 0.97 | NA | NA |
| LPE_(22:5) | ME309749 | 0.78 | 1.17 | NA | 1.17 | NA | NA |
| Carnitine_(C08:1) | ME309661 | 0.90 | 1.19 | NA | 1.02 | NA | NA |
| Carnitine_(C10:1) | ME309666 | 0.81 | 1.30 | NA | 1.07 | NA | NA |
| Carnitine_(C08) | ME309663 | 1.20 | 1.19 | NA | 1.03 | 0.39 | NA |
| Carnitine_(C16:1_OH) | ME309677 | 1.23 | 1.41 | 0.01 | 1.11 | 0.01 | NA |
| LPE_(18:3) | ME309729 | 1.28 | 1.47 | 0.26 | 1.08 | NA | NA |
| Carnitine_(C18:3) | ME309683 | 0.80 | 1.25 | 0.39 | 2.37 | 0.39 | 0.39 |
| Carnitine_(C15) | ME309688 | 1.24 | 1.42 | 0.57 | 2.65 | 0.31 | 0.41 |
| Carnitine_(C18:2) | ME309686 | 1.31 | 1.37 | 0.53 | 2.60 | 0.24 | 0.35 |
| Carnitine_(C14) | ME309684 | 0.95 | 1.91 | 0.41 | 2.59 | 0.24 | 0.24 |
| LPE_(20:3) | ME309757 | 1.11 | 1.87 | 0.38 | 3.17 | 0.19 | 0.26 |
| Carnitine_(C07) | ME309660 | 1.33 | 2.20 | 0.46 | 1.75 | 0.31 | 0.31 |
| Carnitine_(C14:1) | ME309678 | 1.91 | 2.30 | 0.06 | 1.98 | 0.12 | 0.09 |
| LPEO_(18:0) | ME309758 | 2.27 | 1.39 | 0.08 | 1.79 | 0.04 | 0.07 |
| LPC_(18:0) | ME309750 | 1.39 | 1.44 | 0.92 | 1.63 | 0.42 | 0.43 |
| LPE_(18:0) | ME309751 | 1.19 | 1.49 | 0.80 | 1.93 | 0.37 | 0.63 |
| Carnitine_(C03) | ME309644 | 1.71 | 1.25 | 0.25 | 1.33 | 0.76 | 0.66 |
| Carnitine_(C13) | ME309679 | 1.21 | 1.28 | 0.44 | 1.72 | 0.44 | 0.44 |
| Carnitine_(C04) | ME309651 | 1.51 | 1.31 | 0.40 | 1.61 | 0.53 | 0.79 |
| LPE_(15:0) | ME309725 | 1.70 | 1.28 | 0.43 | 1.70 | 0.43 | 0.57 |
| LPE_(17:0) | ME309744 | 1.61 | 1.16 | 0.58 | 1.59 | 0.44 | 0.67 |
| Carnitine_(C05) | ME309654 | 2.15 | 1.57 | 0.26 | 1.16 | 0.23 | 0.23 |
| Carnitine_(C06) | ME309656 | 1.86 | 1.54 | 0.66 | 0.93 | 0.44 | 0.33 |
| LPE_(20:4) | ME309730 | 1.80 | 1.23 | 0.77 | 1.14 | 0.58 | 0.34 |
Factors:
| F1 | Treatment:BIG |
| F2 | Treatment:HB |
| F3 | Treatment:HB101 |
| F4 | Treatment:HBS |
| F5 | Treatment:PA14 |
| F6 | Treatment:P.Lumin |
