Clustering data with hclust algorithm for (Study ST000984)
(Analysis AN001610)| Metabolite | Structure | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 | F9 |
|---|---|---|---|---|---|---|---|---|---|---|
| SM (d34:1) [M+H]+ | ME242743 | 0.96 | 1.03 | 1.03 | 0.96 | 0.99 | 1.02 | 0.89 | 1.11 | 0.87 |
| PE (p-40:5) or PE (o-40:6) [M+H]+ | ME242736 | 0.90 | 0.94 | 1.02 | 0.95 | 1.04 | 1.20 | 0.36 | 1.25 | 0.65 |
| PE (38:6) [M+H]+ | ME242727 | 0.90 | 1.01 | 0.86 | 1.06 | 1.12 | 0.99 | 0.56 | 1.22 | 0.85 |
| PC (39:4) [M+H]+ | ME242684 | 0.95 | 0.98 | 1.06 | 0.94 | 1.04 | 1.04 | 0.87 | 1.08 | 0.85 |
| PC (38:6) C [M+H]+ | ME242682 | 0.83 | 1.04 | 1.15 | 0.90 | 1.02 | 1.14 | 0.58 | 1.10 | 0.79 |
| Hex2Cer (d34:1) [M+H]+ | ME242605 | 0.98 | 1.04 | 1.03 | 0.97 | 0.98 | 1.02 | 0.75 | 1.11 | 0.86 |
| Cer (d40:1) [M+H-H2O]+ | ME242542 | 0.89 | 1.04 | 1.08 | 0.94 | 1.04 | 0.98 | 0.79 | 1.05 | 1.06 |
| CE (18:3) [2M+Na]+ | ME242494 | 1.34 | 0.81 | 0.80 | 1.49 | 0.86 | 1.12 | 1.23 | 0.68 | 0.50 |
| CE (18:2) [2M+Na]+ | ME242488 | 1.11 | 0.96 | 0.99 | 1.10 | 0.96 | 1.02 | 1.03 | 0.92 | 0.83 |
| 1_DG (18:1/2:0/0:0) [M+Na]+ ISTD | ME242429 | 0.99 | 1.00 | 0.99 | 0.99 | 0.99 | 1.00 | 1.07 | 1.03 | 1.02 |
| 1_DG (18:1/2:0/0:0) [M+NH4]+ ISTD | ME242428 | 1.00 | 1.00 | 0.99 | 0.99 | 1.00 | 0.99 | 1.07 | 1.05 | 0.99 |
| CE (18:0) [2M+Na]+ | ME242476 | 1.05 | 1.12 | 1.08 | 0.94 | 0.93 | 0.95 | 0.49 | 1.14 | 0.77 |
| PC (p-40:6) or PC (o-40:7) B [M+H]+ | ME242716 | 0.86 | 1.06 | 1.01 | 0.95 | 1.08 | 1.07 | 0.60 | 1.13 | 0.82 |
| CE (16:0) [Chol-head -H2O+H]+ | ME242465 | 1.07 | 0.99 | 1.01 | 1.03 | 0.95 | 1.00 | 0.87 | 1.05 | 0.87 |
| PC (36:5) C [M+H]+ | ME242665 | 0.93 | 0.98 | 1.04 | 1.03 | 0.96 | 0.98 | 0.94 | 1.16 | 0.94 |
| PE (34:2) [M+H]+ | ME242722 | 0.67 | 1.10 | 1.05 | 0.76 | 1.19 | 1.14 | 0.64 | 1.20 | 0.94 |
| PC (p-36:1) or PC (o-36:2) B [M+H]+ | ME242701 | 0.95 | 0.88 | 1.09 | 1.22 | 1.03 | 1.09 | 1.29 | 0.89 | 0.52 |
| PC (42:10) [M+H]+ | ME242693 | 0.94 | 0.94 | 0.99 | 1.02 | 1.01 | 1.08 | 0.65 | 1.11 | 0.91 |
| PC (37:6) [M+H]+ | ME242671 | 0.94 | 1.03 | 1.04 | 0.98 | 1.03 | 1.01 | 0.37 | 1.12 | 0.88 |
| LPC (20:5) [M+H]+ | ME242627 | 0.99 | 0.92 | 0.95 | 1.19 | 1.17 | 0.98 | 0.72 | 0.92 | 0.70 |
| LPC (18:2) [M+H]+ | ME242623 | 0.89 | 1.05 | 0.96 | 1.00 | 1.10 | 1.06 | 0.76 | 1.08 | 0.78 |
| HexCer (d42:1) [M+H]+ | ME242611 | 1.00 | 0.97 | 1.01 | 0.97 | 1.01 | 1.03 | 0.82 | 1.06 | 0.97 |
| Cer (d34:1) [M+H]+ | ME242532 | 1.07 | 1.07 | 1.01 | 0.85 | 1.09 | 1.06 | 1.13 | 1.07 | 0.56 |
| 1_Cholesterol d7 [M-H2O+H]+ ISTD | ME242423 | 1.00 | 0.99 | 1.00 | 1.03 | 0.98 | 0.99 | 1.13 | 0.98 | 1.03 |
| Acylcarnitine (C18:2) [M+H]+ | ME242452 | 1.01 | 0.92 | 1.11 | 0.92 | 0.97 | 1.05 | 1.27 | 0.94 | 1.08 |
| 1_CE (22:1) [2M+Na]+ ISTD | ME242418 | 1.00 | 1.00 | 0.99 | 1.00 | 1.00 | 1.00 | 1.01 | 1.01 | 1.01 |
| PC (37:5) [M+H]+ | ME242670 | 0.90 | 1.01 | 1.00 | 0.98 | 1.03 | 1.06 | 0.46 | 1.17 | 0.87 |
| 1_PC (12:0/13:0) [M+H]+ ISTD | ME242435 | 0.99 | 1.00 | 0.98 | 1.01 | 0.99 | 1.01 | 1.05 | 1.01 | 1.01 |
| PC (34:3) A [M+H]+ | ME242647 | 0.76 | 1.03 | 1.08 | 0.89 | 0.96 | 1.07 | 1.12 | 1.50 | 0.67 |
| Acylcarnitine (C10:0) [M+H]+ | ME242444 | 1.41 | 0.86 | 1.06 | 1.28 | 0.81 | 0.92 | 0.75 | 0.69 | 0.84 |
| CE (18:2) [M+Chol-head -H2O+H]+ | ME242486 | 1.05 | 1.01 | 1.01 | 1.03 | 0.95 | 0.99 | 0.88 | 1.05 | 0.86 |
| HexCer (d40:1) [M+H]+ | ME242608 | 0.95 | 0.99 | 1.06 | 1.01 | 1.02 | 0.95 | 0.72 | 1.05 | 1.01 |
| PC (38:4) B [M+H]+ | ME242676 | 0.93 | 1.00 | 0.90 | 0.97 | 1.00 | 1.05 | 1.07 | 1.13 | 1.10 |
| LPC (20:4) [M+H]+ | ME242626 | 1.06 | 1.01 | 0.89 | 1.13 | 1.00 | 0.92 | 1.01 | 1.08 | 0.88 |
| PC (35:2) B [M+H]+ | ME242653 | 0.90 | 1.06 | 1.09 | 0.92 | 0.98 | 1.08 | 0.54 | 1.09 | 0.92 |
| PC (36:2) [M+H]+ | ME242657 | 0.86 | 1.04 | 1.07 | 0.91 | 1.03 | 1.10 | 0.71 | 1.10 | 0.89 |
| CE (16:1) [M+Na]+ | ME242467 | 1.02 | 0.95 | 0.99 | 1.08 | 0.94 | 0.96 | 1.40 | 1.19 | 0.74 |
| CE (20:5) [M+Na]+ | ME242515 | 1.23 | 0.92 | 0.92 | 1.46 | 0.90 | 0.94 | 0.68 | 0.88 | 0.43 |
| SM (d36:0) [M+H]+ | ME242745 | 0.98 | 1.00 | 0.96 | 0.99 | 1.01 | 1.01 | 1.07 | 1.16 | 0.85 |
| DG (34:1) [M+Na]+ | ME242591 | 0.70 | 1.16 | 1.13 | 0.75 | 0.98 | 1.02 | 1.11 | 1.15 | 1.32 |
| CE (20:3) [Chol-head -H2O+H]+ | ME242507 | 1.05 | 1.00 | 1.01 | 1.03 | 0.96 | 1.00 | 0.92 | 1.03 | 0.86 |
| PC (p-38:3) or PC (o-38:4) B [M+H]+ | ME242706 | 0.99 | 1.05 | 1.04 | 0.97 | 0.98 | 1.02 | 0.72 | 1.07 | 0.87 |
| PC (36:3) B [M+H]+ | ME242659 | 0.95 | 1.07 | 1.06 | 0.89 | 0.94 | 1.00 | 0.84 | 1.13 | 1.05 |
| PC (p-32:1) or PC (o-32:2) [M+H]+ | ME242696 | 0.96 | 1.04 | 1.04 | 0.95 | 1.00 | 1.04 | 0.88 | 1.08 | 0.86 |
| DG (38:5) [M+NH4]+ | ME242575 | 0.88 | 1.03 | 1.10 | 0.93 | 0.97 | 1.08 | 0.49 | 1.01 | 1.09 |
| SM (d36:2) [M+H]+ | ME242747 | 0.96 | 1.04 | 1.02 | 0.96 | 0.98 | 1.02 | 0.74 | 1.14 | 0.88 |
| PC (36:4) A [M+H]+ | ME242660 | 0.87 | 0.98 | 1.04 | 0.99 | 1.04 | 1.15 | 0.65 | 0.99 | 0.91 |
| SM (d33:1) [M+H]+ | ME242741 | 0.97 | 1.04 | 1.04 | 0.97 | 0.97 | 1.01 | 0.59 | 1.11 | 0.90 |
| SM (d32:0) [M+H]+ | ME242738 | 0.96 | 0.98 | 1.04 | 1.01 | 1.02 | 1.03 | 0.51 | 1.10 | 0.88 |
| LPC (16:1) [M+H]+ | ME242620 | 0.98 | 1.00 | 0.91 | 1.05 | 1.02 | 0.94 | 1.53 | 1.13 | 0.93 |
| PC (33:1) [M+H]+ | ME242642 | 0.96 | 1.03 | 1.02 | 0.97 | 0.99 | 1.01 | 0.55 | 1.11 | 0.95 |
| Cer (d42:2) A [M+Na]+ | ME242552 | 0.93 | 1.01 | 0.96 | 0.92 | 1.01 | 1.09 | 0.69 | 1.14 | 1.00 |
| 1_DG (12:0/12:0/0:0) [M+Na]+ ISTD | ME242426 | 0.98 | 0.99 | 0.99 | 1.01 | 0.98 | 1.00 | 1.02 | 1.02 | 1.06 |
| DG (36:4) B [M+Na]+ | ME242573 | 0.48 | 0.52 | 0.51 | 0.51 | 1.42 | 1.98 | 0.56 | 1.02 | 1.18 |
| PC (p-38:4) or PC (o-38:5) B [M+H]+ | ME242708 | 0.99 | 1.06 | 1.05 | 0.95 | 0.98 | 1.00 | 0.75 | 1.11 | 0.86 |
| PC (p-36:1) or PC (o-36:2) A [M+H]+ | ME242700 | 0.96 | 1.01 | 1.00 | 1.01 | 1.04 | 1.05 | 0.88 | 1.06 | 0.80 |
| PC (40:6) B [M+H]+ | ME242689 | 0.90 | 0.98 | 0.98 | 0.99 | 1.02 | 1.05 | 0.67 | 1.17 | 0.96 |
| PC (38:4) A [M+H]+ | ME242675 | 0.97 | 1.03 | 1.05 | 0.94 | 0.94 | 1.04 | 0.77 | 1.06 | 1.03 |
| Cer (d42:2) B [M+Na]+ | ME242555 | 0.98 | 1.12 | 1.06 | 0.91 | 0.95 | 0.92 | 0.66 | 1.08 | 1.12 |
| LPE (18:2) [M+H]+ | ME242630 | 0.64 | 1.17 | 1.05 | 0.71 | 1.23 | 1.13 | 0.80 | 1.16 | 0.91 |
| CE (22:6) [M+Na]+ | ME242527 | 1.22 | 0.89 | 0.97 | 1.31 | 0.90 | 0.98 | 0.75 | 0.86 | 0.68 |
| PC (38:4) C [M+H]+ | ME242677 | 0.93 | 1.02 | 1.03 | 0.95 | 0.99 | 1.03 | 0.78 | 1.12 | 0.94 |
| PC (o-34:0) [M+H]+ | ME242695 | 0.99 | 0.99 | 1.01 | 0.98 | 1.01 | 1.04 | 0.68 | 1.08 | 0.89 |
| PC (34:0) [M+H]+ | ME242644 | 0.99 | 1.00 | 1.03 | 0.98 | 0.99 | 1.04 | 0.67 | 1.07 | 0.89 |
| 1_CE (22:1) [M+Chol-head -H2O+H]+ ISTD | ME242416 | 0.99 | 1.00 | 0.98 | 1.00 | 0.98 | 1.00 | 1.05 | 1.01 | 1.05 |
| CE (18:1) [2M+Na]+ | ME242482 | 1.15 | 0.93 | 0.99 | 1.12 | 0.93 | 1.02 | 0.98 | 0.93 | 0.84 |
| PC (p-42:5) or PC (o-42:6) A [M+H]+ | ME242719 | 0.97 | 1.04 | 1.04 | 0.99 | 0.91 | 1.03 | 0.81 | 1.04 | 1.03 |
| LPC (18:3) [M+H]+ | ME242624 | 0.65 | 0.70 | 0.57 | 0.69 | 1.26 | 2.11 | 0.63 | 0.96 | 0.95 |
| CE (22:2) [2M+Na]+ | ME242524 | 1.06 | 0.99 | 1.02 | 1.04 | 0.93 | 0.97 | 1.06 | 1.03 | 0.92 |
| CE (16:1) [2M+Na]+ | ME242470 | 1.04 | 0.95 | 0.97 | 1.11 | 0.93 | 0.97 | 1.61 | 1.15 | 0.71 |
| CE (18:3) [M+NH4]+ | ME242490 | 0.90 | 0.97 | 0.91 | 0.99 | 1.02 | 1.11 | 0.80 | 1.13 | 1.00 |
| 1_LPC (17:0) [M+H]+ ISTD | ME242431 | 0.99 | 1.00 | 0.99 | 1.00 | 0.99 | 1.00 | 1.08 | 1.02 | 1.02 |
| 1_Cer (d18:1/17:0) [M+Na]+ ISTD | ME242422 | 0.98 | 0.99 | 0.98 | 1.00 | 0.98 | 1.00 | 1.03 | 1.05 | 1.06 |
| Cer (d42:1) [M+H]+ | ME242547 | 0.99 | 1.05 | 1.04 | 0.93 | 0.96 | 0.99 | 0.82 | 1.06 | 1.05 |
| SM (d36:3) [M+H]+ | ME242748 | 1.03 | 1.06 | 1.02 | 0.93 | 0.96 | 0.97 | 1.14 | 1.08 | 0.94 |
| CE (16:1) [M+NH4]+ | ME242466 | 0.95 | 0.98 | 0.98 | 1.03 | 0.97 | 0.99 | 1.28 | 1.21 | 0.84 |
| SM (d30:1) [M+H]+ | ME242737 | 0.93 | 1.00 | 1.01 | 0.99 | 0.99 | 1.05 | 0.56 | 1.08 | 0.99 |
| Cer (d41:1) [M+H-H2O]+ | ME242545 | 0.87 | 1.08 | 1.05 | 0.99 | 0.99 | 0.98 | 0.65 | 1.10 | 1.01 |
| 1_DG (18:1/2:0/0:0) [M+K]+ ISTD | ME242430 | 0.99 | 0.99 | 0.98 | 1.00 | 1.01 | 1.00 | 1.01 | 1.03 | 1.03 |
| CE (20:4) [M+Na]+ | ME242509 | 1.30 | 1.01 | 1.06 | 1.25 | 0.80 | 0.82 | 1.28 | 0.87 | 0.70 |
| CE (20:5) [Chol-head -H2O+H]+ | ME242519 | 0.78 | 1.01 | 0.72 | 1.13 | 1.10 | 1.09 | 0.74 | 1.36 | 0.83 |
| PC (32:2) [M+H]+ | ME242640 | 0.92 | 1.00 | 1.06 | 0.95 | 0.98 | 1.08 | 0.62 | 1.02 | 1.06 |
| PC (28:0) [M+H]+ | ME242634 | 0.71 | 1.00 | 1.08 | 0.77 | 0.90 | 1.29 | 0.60 | 1.16 | 1.33 |
| DG (36:4) A [M+Na]+ | ME242570 | 0.69 | 1.05 | 1.06 | 0.70 | 1.07 | 1.25 | 0.52 | 1.06 | 1.36 |
| Cholesterol [M-H2O+H]+ | ME242556 | 0.98 | 1.01 | 1.02 | 0.98 | 0.98 | 1.01 | 0.87 | 1.05 | 0.98 |
| CE (18:3) [Chol-head -H2O+H]+ | ME242495 | 0.86 | 1.01 | 0.96 | 0.92 | 1.00 | 1.14 | 0.90 | 1.18 | 0.97 |
| 1_Sphingosine (d17:1) [M+H]+ ISTD | ME242438 | 0.98 | 0.99 | 0.99 | 1.01 | 0.98 | 0.99 | 1.17 | 1.05 | 1.01 |
| CE (16:0) [M+Na]+ | ME242461 | 1.09 | 0.94 | 0.99 | 1.06 | 0.96 | 1.01 | 1.12 | 1.00 | 0.88 |
| SM (d34:0) [M+H]+ | ME242742 | 0.95 | 1.01 | 1.02 | 0.99 | 1.00 | 1.02 | 0.89 | 1.12 | 0.86 |
| PC (p-36:5) or PC (o-36:6) [M+H]+ | ME242704 | 0.91 | 0.97 | 0.94 | 1.05 | 1.05 | 1.05 | 0.56 | 1.28 | 0.67 |
| PC (40:5) B [M+H]+ | ME242687 | 0.94 | 1.01 | 1.01 | 0.93 | 0.98 | 1.01 | 1.00 | 1.08 | 1.12 |
| PC (38:6) B [M+H]+ | ME242681 | 0.92 | 0.99 | 0.99 | 0.99 | 1.01 | 1.04 | 0.60 | 1.18 | 0.90 |
| PC (38:6) A [M+H]+ | ME242680 | 0.96 | 1.02 | 1.01 | 0.99 | 1.00 | 1.03 | 0.73 | 1.05 | 0.96 |
| PC (38:5) A [M+H]+ | ME242678 | 0.94 | 1.02 | 1.03 | 0.96 | 0.99 | 1.04 | 0.74 | 1.10 | 0.93 |
| PC (36:6) [M+H]+ | ME242667 | 0.93 | 1.01 | 1.03 | 0.97 | 1.00 | 1.03 | 0.51 | 1.10 | 0.99 |
| PC (35:3) [M+H]+ | ME242654 | 0.90 | 1.04 | 1.07 | 0.94 | 0.99 | 1.07 | 0.57 | 1.09 | 0.92 |
| PC (34:1) [M+H]+ | ME242645 | 0.94 | 1.00 | 1.02 | 0.97 | 0.99 | 1.03 | 0.83 | 1.13 | 0.92 |
| LPE (22:3) [M+H]+ | ME242632 | 0.99 | 1.00 | 1.01 | 1.02 | 0.98 | 1.00 | 1.01 | 0.99 | 0.99 |
| DG (36:1) [M+K]+ | ME242601 | 0.38 | 1.45 | 1.05 | 0.43 | 1.32 | 1.07 | 0.28 | 1.42 | 1.15 |
| CE (20:4) [M+NH4]+ | ME242508 | 1.07 | 1.05 | 1.05 | 1.01 | 0.93 | 0.93 | 0.88 | 1.07 | 0.87 |
| 1_DG (12:0/12:0/0:0) [M+K]+ ISTD | ME242427 | 0.99 | 0.98 | 0.96 | 1.01 | 1.00 | 1.02 | 0.93 | 1.01 | 1.06 |
| CE (20:3) [M+Na]+ | ME242503 | 1.42 | 0.88 | 0.79 | 1.08 | 0.94 | 0.95 | 0.93 | 0.99 | 0.88 |
| PC (40:4) [M+H]+ | ME242685 | 0.92 | 0.98 | 1.01 | 0.95 | 0.98 | 1.01 | 1.11 | 1.10 | 1.12 |
| 1_TG d5 (17:0/17:1/17:0) ISTD [M+NH4]+ | ME242439 | 0.95 | 1.02 | 0.98 | 0.97 | 1.02 | 1.02 | 0.95 | 1.00 | 1.07 |
| Cer (d42:2) A [M+H]+ | ME242550 | 0.89 | 0.99 | 0.99 | 0.95 | 1.03 | 1.12 | 0.44 | 1.11 | 0.98 |
| PC (32:0) [M+H]+ | ME242638 | 0.95 | 0.99 | 1.03 | 0.97 | 1.00 | 1.06 | 0.79 | 1.10 | 0.90 |
| PC (35:4) [M+H]+ | ME242655 | 0.96 | 1.05 | 1.06 | 0.95 | 0.98 | 1.02 | 0.49 | 1.08 | 0.96 |
| CE (18:2) [M+NH4]+ | ME242484 | 1.07 | 0.99 | 1.00 | 1.05 | 0.95 | 1.01 | 0.92 | 1.02 | 0.84 |
| HexCer (d42:1) [M+Na]+ | ME242613 | 0.94 | 1.03 | 0.98 | 1.02 | 0.99 | 1.03 | 0.92 | 1.03 | 0.99 |
| SM (d32:2) [M+H]+ | ME242740 | 0.96 | 1.02 | 0.99 | 0.97 | 1.00 | 1.05 | 0.72 | 0.99 | 1.08 |
| PE (36:4) [M+H]+ | ME242725 | 0.79 | 1.07 | 0.99 | 0.87 | 1.12 | 1.03 | 0.63 | 1.26 | 0.95 |
| PC (p-42:2) or PC (o-42:3) [M+H]+ | ME242717 | 0.96 | 1.01 | 1.00 | 1.05 | 1.04 | 1.01 | 0.85 | 0.98 | 0.89 |
| PC (35:2) A [M+H]+ | ME242652 | 1.01 | 0.98 | 1.08 | 0.95 | 1.02 | 1.06 | 0.43 | 1.04 | 0.84 |
| LPC (16:0) [M+H]+ | ME242619 | 0.97 | 1.03 | 0.94 | 1.02 | 1.04 | 0.96 | 1.21 | 1.09 | 0.90 |
| DG (38:5) [M+Na]+ | ME242576 | 0.83 | 1.06 | 1.21 | 0.91 | 0.97 | 1.08 | 0.77 | 0.91 | 1.08 |
| DG (36:5) [M+Na]+ | ME242561 | 0.67 | 0.66 | 0.69 | 0.67 | 1.43 | 1.73 | 0.76 | 0.98 | 1.22 |
| CE (20:4) [Chol-head -H2O+H]+ | ME242513 | 1.03 | 1.06 | 1.04 | 0.97 | 0.95 | 0.95 | 0.85 | 1.10 | 0.91 |
| Cer (d38:1) [M+Na]+ | ME242540 | 0.98 | 1.05 | 1.05 | 0.96 | 0.98 | 0.93 | 0.64 | 1.00 | 1.18 |
| SM (d34:2) [M+H]+ | ME242744 | 0.97 | 1.03 | 1.02 | 0.98 | 0.98 | 1.01 | 0.88 | 1.09 | 0.92 |
| PC (p-40:4) or PC (o-40:5) [M+H]+ | ME242713 | 0.98 | 1.04 | 1.04 | 0.99 | 0.98 | 1.01 | 0.74 | 1.08 | 0.89 |
| PC (40:6) A [M+H]+ | ME242688 | 1.01 | 0.99 | 1.03 | 0.97 | 1.00 | 0.99 | 0.92 | 1.09 | 0.91 |
| Cer (d34:1) [M+Na]+ | ME242534 | 0.88 | 1.03 | 1.02 | 0.87 | 0.98 | 0.98 | 0.88 | 1.15 | 1.29 |
| LPC (18:1) [M+H]+ | ME242622 | 1.04 | 1.02 | 0.94 | 1.10 | 1.02 | 0.95 | 0.98 | 1.04 | 0.80 |
| LPE (18:0) [M+H]+ | ME242629 | 0.86 | 0.97 | 1.09 | 0.98 | 1.05 | 0.97 | 1.01 | 1.19 | 0.89 |
| PE (38:4) [M+H]+ | ME242726 | 0.82 | 1.05 | 1.01 | 0.86 | 1.12 | 1.06 | 0.53 | 1.23 | 0.91 |
| PC (32:1) [M+H]+ | ME242639 | 0.91 | 0.97 | 0.97 | 0.98 | 1.00 | 1.01 | 1.10 | 1.17 | 1.00 |
| PC (31:0) [M+H]+ | ME242636 | 0.99 | 1.04 | 1.02 | 0.99 | 1.01 | 1.01 | 0.28 | 1.08 | 0.93 |
| PC (30:0) [M+H]+ | ME242635 | 0.97 | 1.00 | 1.01 | 0.99 | 0.97 | 1.04 | 0.64 | 1.07 | 1.03 |
| CE (16:0) [2M+Na]+ | ME242464 | 1.10 | 0.92 | 0.99 | 1.11 | 0.92 | 1.01 | 1.08 | 0.99 | 0.86 |
| CE (18:0) [M+Na]+ | ME242473 | 1.00 | 0.99 | 1.05 | 0.96 | 0.97 | 1.02 | 0.61 | 1.15 | 0.85 |
| Acylcarnitine (C18:1) [M+H]+ | ME242451 | 1.13 | 1.00 | 1.02 | 1.15 | 0.84 | 0.94 | 1.17 | 0.94 | 0.90 |
| CE (22:6) [M+NH4]+ | ME242526 | 0.86 | 1.06 | 0.99 | 0.89 | 1.03 | 1.02 | 0.61 | 1.23 | 1.05 |
| PC (38:5) B [M+H]+ | ME242679 | 0.95 | 0.96 | 1.02 | 1.08 | 0.98 | 1.07 | 0.89 | 1.13 | 0.68 |
| PC (34:3) C [M+H]+ | ME242649 | 0.28 | 0.33 | 0.47 | 0.36 | 1.50 | 2.57 | 0.10 | 1.31 | 1.40 |
| HexCer (d40:1) [M+Na]+ | ME242610 | 0.99 | 0.98 | 1.03 | 0.98 | 1.01 | 1.04 | 0.86 | 1.02 | 0.94 |
| CE (22:2) [M+Na]+ | ME242521 | 1.02 | 1.03 | 1.02 | 1.02 | 0.93 | 0.97 | 0.90 | 1.08 | 0.93 |
| CE (20:3) [M+NH4]+ | ME242502 | 1.24 | 0.91 | 0.95 | 1.15 | 0.91 | 0.96 | 1.12 | 0.91 | 0.85 |
| CE (18:1) [M+Na]+ | ME242479 | 1.12 | 0.93 | 0.98 | 1.11 | 0.93 | 1.02 | 1.03 | 0.95 | 0.87 |
| CE (18:2) [M+Na]+ | ME242485 | 1.08 | 0.96 | 1.00 | 1.08 | 0.97 | 1.01 | 1.02 | 0.95 | 0.86 |
| PE (p-34:1) or PE (o-34:2) [M+H]+ | ME242728 | 1.03 | 1.00 | 0.95 | 0.93 | 1.03 | 1.12 | 0.27 | 1.11 | 0.82 |
| PC (p-36:4) or PC (o-36:5) [M+H]+ | ME242703 | 0.97 | 1.05 | 1.03 | 0.96 | 0.99 | 1.00 | 0.75 | 1.15 | 0.84 |
| PC (34:3) B [M+H]+ | ME242648 | 0.91 | 1.00 | 0.96 | 1.03 | 0.93 | 1.08 | 0.79 | 1.11 | 1.05 |
| PC (p-36:2) or PC (o-36:3) [M+H]+ | ME242702 | 0.92 | 1.01 | 0.99 | 1.00 | 1.04 | 1.07 | 0.76 | 1.07 | 0.86 |
| Cer (d41:1) [M+H]+ | ME242544 | 0.94 | 1.05 | 1.03 | 0.95 | 1.01 | 1.01 | 0.60 | 1.08 | 1.00 |
| CE (22:2) [Chol-head -H2O+H]+ | ME242525 | 1.01 | 1.07 | 0.98 | 1.00 | 0.96 | 0.92 | 0.64 | 1.14 | 1.04 |
| DG (36:2) [M+NH4]+ | ME242593 | 0.97 | 1.13 | 1.18 | 0.94 | 0.87 | 0.94 | 1.00 | 1.00 | 0.97 |
| 1_CE (22:1) [M+Na]+ ISTD | ME242415 | 1.00 | 1.00 | 0.99 | 1.01 | 0.99 | 0.99 | 1.02 | 1.01 | 1.01 |
| 1_LPE (17:1) [M+H]+ ISTD | ME242432 | 0.99 | 1.00 | 0.99 | 1.00 | 0.99 | 1.00 | 1.07 | 1.01 | 1.01 |
| Cer (d40:1) [M+Na]+ | ME242543 | 0.98 | 1.06 | 1.06 | 0.92 | 0.96 | 0.98 | 0.64 | 1.07 | 1.09 |
| SM (d36:1) [M+H]+ | ME242746 | 0.97 | 1.03 | 1.01 | 0.97 | 0.99 | 1.01 | 0.77 | 1.13 | 0.90 |
| PC (36:4) C [M+H]+ | ME242662 | 0.93 | 1.02 | 1.03 | 0.95 | 0.99 | 1.04 | 0.80 | 1.13 | 0.94 |
| PC (p-40:3) or PC (o-40:4) [M+H]+ | ME242712 | 0.98 | 1.04 | 1.03 | 0.97 | 0.99 | 1.03 | 0.69 | 1.07 | 0.88 |
| DG (36:4) A [M+NH4]+ | ME242569 | 0.62 | 1.07 | 1.11 | 0.67 | 1.10 | 1.31 | 0.56 | 1.06 | 1.24 |
| PC (35:1) [M+H]+ | ME242651 | 0.96 | 1.06 | 1.06 | 0.94 | 0.99 | 1.01 | 0.57 | 1.09 | 0.92 |
| PC (36:3) A [M+H]+ | ME242658 | 0.81 | 0.99 | 1.06 | 0.96 | 1.03 | 1.12 | 0.75 | 1.13 | 0.90 |
| PC (p-44:4) or PC (o-44:5) [M+H]+ | ME242721 | 0.98 | 1.03 | 1.03 | 0.99 | 0.98 | 1.01 | 0.69 | 1.05 | 0.97 |
| PC (40:5) A [M+H]+ | ME242686 | 0.91 | 0.98 | 0.99 | 0.97 | 1.01 | 1.05 | 0.82 | 1.12 | 1.01 |
| CE (18:1) [M+Chol-head -H2O+H]+ | ME242480 | 1.07 | 1.00 | 1.03 | 1.02 | 0.93 | 0.99 | 0.83 | 1.05 | 0.87 |
| LPC (14:0) [M+H]+ | ME242617 | 0.94 | 1.02 | 0.94 | 0.99 | 0.99 | 0.97 | 1.17 | 1.15 | 1.06 |
| Acylcarnitine (C8:0) [M+H]+ | ME242442 | 1.13 | 1.12 | 0.87 | 0.88 | 1.18 | 1.13 | 1.21 | 0.28 | 1.40 |
| PC (33:0) [M+H]+ | ME242641 | 0.96 | 1.03 | 1.04 | 0.97 | 0.99 | 1.01 | 0.52 | 1.10 | 0.96 |
| PE (p-36:2) or PE (o-36:3) [M+H]+ | ME242730 | 0.94 | 1.02 | 1.05 | 0.98 | 1.00 | 1.05 | 0.83 | 1.06 | 0.87 |
| Acylcarnitine (C12:0) [M+H]+ | ME242446 | 1.23 | 1.02 | 1.05 | 1.03 | 0.85 | 1.04 | 1.02 | 0.83 | 0.83 |
| Cer (d42:1) [M+H-H2O]+ | ME242548 | 0.96 | 1.04 | 1.06 | 0.95 | 0.98 | 0.99 | 0.76 | 1.04 | 1.06 |
| DG (34:2) [M+K]+ | ME242583 | 0.81 | 1.03 | 1.06 | 0.67 | 1.05 | 1.14 | 0.58 | 1.05 | 1.53 |
| PC (38:3) [M+H]+ | ME242674 | 0.93 | 1.02 | 1.03 | 0.93 | 0.97 | 1.03 | 0.79 | 1.09 | 1.10 |
| PC (34:2) [M+H]+ | ME242646 | 0.88 | 1.01 | 1.05 | 0.94 | 1.02 | 1.08 | 0.77 | 1.10 | 0.92 |
| PC (o-32:0) [M+H]+ | ME242694 | 0.95 | 1.00 | 1.01 | 0.99 | 1.02 | 1.04 | 0.82 | 1.07 | 0.88 |
| PC (33:2) [M+H]+ | ME242643 | 0.94 | 1.04 | 1.05 | 0.95 | 1.01 | 1.06 | 0.45 | 1.07 | 0.91 |
| PC (p-38:3) or PC (o-38:4) A [M+H]+ | ME242705 | 1.02 | 1.09 | 1.04 | 0.84 | 0.97 | 1.06 | 1.18 | 0.96 | 1.00 |
| Cer (d41:1) [M+Na]+ | ME242546 | 0.97 | 1.04 | 1.05 | 0.94 | 0.98 | 0.99 | 0.62 | 1.11 | 1.00 |
| PE (36:1) [M+H]+ | ME242723 | 0.65 | 1.13 | 1.14 | 0.67 | 1.20 | 1.12 | 0.64 | 1.20 | 0.96 |
| PE (p-36:4) or PE (o-36:5) [M+H]+ | ME242731 | 0.93 | 0.97 | 1.05 | 0.94 | 1.01 | 1.07 | 0.61 | 1.26 | 0.73 |
| PC (p-38:5) or PC (o-38:6) B [M+H]+ | ME242710 | 0.96 | 1.01 | 1.01 | 0.99 | 1.00 | 1.02 | 0.87 | 1.10 | 0.88 |
| Cer (d42:1) [M+Na]+ | ME242549 | 0.97 | 1.05 | 1.06 | 0.95 | 0.96 | 0.98 | 0.77 | 1.04 | 1.07 |
| PC (p-34:1) or PC (o-34:2) [M+H]+ | ME242698 | 0.90 | 0.97 | 0.95 | 1.04 | 1.05 | 1.08 | 0.93 | 1.14 | 0.79 |
| DG (34:2) [M+Na]+ | ME242582 | 0.79 | 1.11 | 1.11 | 0.77 | 0.99 | 1.12 | 0.80 | 1.06 | 1.22 |
| CE (18:3) [M+Na]+ | ME242491 | 1.27 | 0.82 | 0.83 | 1.43 | 0.89 | 1.08 | 1.21 | 0.78 | 0.55 |
| PC (37:4) [M+H]+ | ME242669 | 1.01 | 1.08 | 0.99 | 0.97 | 0.91 | 1.22 | 0.50 | 1.04 | 0.66 |
| PC (p-38:6) or PC (o-38:7) [M+H]+ | ME242711 | 0.92 | 1.00 | 0.98 | 1.01 | 1.04 | 1.03 | 0.59 | 1.20 | 0.80 |
| DG (36:2) [M+K]+ | ME242595 | 1.06 | 1.21 | 1.22 | 0.70 | 0.88 | 0.79 | 0.21 | 1.22 | 1.22 |
| PE (p-38:5) or PE (o-38:6) [M+H]+ | ME242733 | 0.93 | 0.99 | 1.02 | 0.98 | 1.00 | 1.09 | 0.63 | 1.18 | 0.77 |
| 1_PE (17:0/17:0) [M+H]+ ISTD | ME242436 | 0.99 | 0.99 | 1.00 | 1.01 | 1.00 | 1.01 | 1.08 | 0.98 | 1.02 |
| LPC (18:0) [M+H]+ | ME242621 | 1.00 | 1.02 | 0.95 | 1.03 | 1.01 | 0.97 | 1.19 | 1.06 | 0.89 |
| DG (34:1) [M+NH4]+ | ME242590 | 0.93 | 1.10 | 1.13 | 0.88 | 0.89 | 1.04 | 1.09 | 0.99 | 1.09 |
| PC (36:1) [M+H]+ | ME242656 | 0.91 | 1.02 | 1.04 | 0.95 | 1.01 | 1.05 | 0.77 | 1.10 | 0.92 |
| PC (p-40:6) or PC (o-40:7) A [M+H]+ | ME242715 | 0.92 | 0.99 | 1.00 | 1.01 | 1.03 | 1.06 | 0.63 | 1.15 | 0.82 |
| PE (p-38:4) or PE (o-38:5) [M+H]+ | ME242732 | 0.97 | 1.01 | 1.08 | 0.92 | 0.99 | 1.06 | 0.62 | 1.16 | 0.77 |
| PC (40:8) [M+H]+ | ME242692 | 0.87 | 1.00 | 1.01 | 0.99 | 1.04 | 1.10 | 0.68 | 1.07 | 0.94 |
| CE (16:0) [M+NH4]+ | ME242460 | 1.06 | 0.96 | 1.01 | 1.04 | 0.95 | 1.00 | 0.99 | 1.03 | 0.91 |
| DG (36:5) [M+NH4]+ | ME242560 | 0.60 | 0.60 | 0.60 | 0.60 | 1.43 | 1.94 | 0.58 | 1.00 | 1.35 |
| LPC (15:0) [M+H]+ | ME242618 | 0.99 | 1.07 | 0.95 | 0.96 | 1.05 | 0.98 | 0.84 | 1.05 | 0.97 |
| PC (36:5) A [M+H]+ | ME242663 | 0.71 | 0.84 | 0.97 | 0.89 | 1.08 | 1.74 | 0.45 | 0.81 | 0.80 |
| 1_MG (17:0/0:0/0:0) [M+Na]+ ISTD | ME242434 | 0.99 | 1.00 | 1.02 | 1.01 | 0.98 | 0.99 | 1.05 | 1.07 | 0.91 |
| LPC (22:5) [M+H]+ | ME242628 | 1.10 | 0.94 | 0.98 | 1.21 | 0.95 | 0.89 | 1.21 | 1.08 | 0.67 |
| 1_Cer (d18:1/17:0) [M+H-H2O]+ ISTD | ME242421 | 0.99 | 1.00 | 0.99 | 1.01 | 0.99 | 1.00 | 1.06 | 0.99 | 1.02 |
| LPE (20:4) [M+H]+ | ME242631 | 0.82 | 1.08 | 0.90 | 0.94 | 1.10 | 1.01 | 0.90 | 1.19 | 1.05 |
| DG (36:2) [M+Na]+ | ME242594 | 0.87 | 1.18 | 1.14 | 0.86 | 0.94 | 0.91 | 0.62 | 1.11 | 1.16 |
| LPC (20:3) [M+H]+ | ME242625 | 1.04 | 1.02 | 0.90 | 1.11 | 0.98 | 0.94 | 0.88 | 1.06 | 0.95 |
| 1_Cer (d18:1/17:0) [M+H]+ ISTD | ME242420 | 0.99 | 1.00 | 1.00 | 1.00 | 0.99 | 1.01 | 1.07 | 1.01 | 1.00 |
| CE (20:5) [M+NH4]+ | ME242514 | 0.81 | 0.94 | 0.92 | 0.97 | 1.11 | 1.10 | 0.59 | 1.35 | 0.83 |
| PC (p-40:5) or PC (o-40:6) [M+H]+ | ME242714 | 0.95 | 1.00 | 1.01 | 0.99 | 1.02 | 1.03 | 0.61 | 1.15 | 0.84 |
| PE (p-40:4) or PE (o-40:5) B [M+H]+ | ME242735 | 0.90 | 0.97 | 1.14 | 0.89 | 1.03 | 1.08 | 0.66 | 1.15 | 0.82 |
| PC (37:2) [M+H]+ | ME242668 | 0.91 | 1.06 | 1.05 | 0.93 | 1.02 | 1.06 | 0.59 | 1.07 | 0.92 |
| SM (d32:1) [M+H]+ | ME242739 | 0.96 | 1.03 | 1.04 | 0.96 | 0.99 | 1.04 | 0.57 | 1.08 | 0.94 |
| 1_CE (22:1) [Chol-head -H2O+H]+ ISTD | ME242419 | 0.99 | 1.00 | 0.99 | 1.00 | 0.99 | 1.00 | 1.03 | 1.02 | 1.03 |
| DG (36:3) [M+NH4]+ | ME242584 | 0.76 | 1.16 | 1.17 | 0.78 | 1.00 | 1.08 | 0.57 | 1.05 | 1.17 |
| 1_SM (d18:1/17:0) [M+H]+ ISTD | ME242437 | 0.97 | 1.02 | 1.00 | 1.00 | 0.99 | 1.01 | 0.94 | 1.05 | 0.97 |
| 1_CUDA [M+H]+ ISTD | ME242424 | 0.99 | 1.00 | 1.01 | 1.01 | 0.99 | 0.99 | 1.10 | 1.02 | 0.99 |
| Cer (d42:2) B [M+H]+ | ME242553 | 1.06 | 0.92 | 1.10 | 0.78 | 1.12 | 1.01 | 1.37 | 0.99 | 0.97 |
| Hex2Cer (d34:1) [M+Na]+ | ME242607 | 0.98 | 1.01 | 1.05 | 0.95 | 1.01 | 1.00 | 0.82 | 1.12 | 0.87 |
| PC (p-38:4) or PC (o-38:5) A [M+H]+ | ME242707 | 0.98 | 1.03 | 1.02 | 0.98 | 0.99 | 1.02 | 0.79 | 1.09 | 0.86 |
| CE (20:4) [2M+Na]+ | ME242512 | 1.34 | 1.01 | 1.03 | 1.31 | 0.78 | 0.79 | 1.39 | 0.81 | 0.68 |
| PC (40:7) B [M+H]+ | ME242691 | 0.94 | 1.03 | 1.05 | 0.97 | 1.00 | 1.05 | 0.58 | 1.11 | 0.85 |
| 1_CE (22:1) [M+NH4]+ ISTD | ME242414 | 0.99 | 1.00 | 0.98 | 1.01 | 0.99 | 1.00 | 1.02 | 1.01 | 1.04 |
| 1_TG d5 (17:0/17:1/17:0) ISTD [M+Na]+ | ME242440 | 1.01 | 1.00 | 1.01 | 1.03 | 0.96 | 1.02 | 1.04 | 0.96 | 0.98 |
| PC (40:7) A [M+H]+ | ME242690 | 0.89 | 1.03 | 1.12 | 0.81 | 0.90 | 1.20 | 0.49 | 1.07 | 1.13 |
| PC (36:4) B [M+H]+ | ME242661 | 0.71 | 0.87 | 0.62 | 0.84 | 1.15 | 1.48 | 0.90 | 1.21 | 1.28 |
| PC (p-38:5) or PC (o-38:6) A [M+H]+ | ME242709 | 0.93 | 0.99 | 0.98 | 1.02 | 1.04 | 1.01 | 0.64 | 1.20 | 0.81 |
| PC (38:2) [M+H]+ | ME242673 | 0.94 | 1.01 | 1.02 | 0.95 | 0.99 | 1.03 | 0.94 | 1.08 | 1.03 |
| PC (34:4) [M+H]+ | ME242650 | 0.94 | 1.01 | 1.05 | 0.93 | 0.96 | 1.06 | 0.69 | 1.05 | 1.12 |
| DG (36:3) [M+K]+ | ME242586 | 0.77 | 1.16 | 1.10 | 0.78 | 0.99 | 1.07 | 0.59 | 1.08 | 1.24 |
| PC (p-34:2) or PC (o-34:3) [M+H]+ | ME242699 | 0.89 | 1.00 | 1.00 | 1.00 | 1.05 | 1.09 | 0.72 | 1.11 | 0.82 |
| 1_MG (17:0/0:0/0:0) [M+H]+ ISTD | ME242433 | 0.99 | 0.98 | 0.99 | 1.00 | 0.99 | 1.00 | 1.08 | 1.02 | 1.02 |
| PC (p-42:4) or PC (o-42:5) [M+H]+ | ME242718 | 0.96 | 0.99 | 1.04 | 1.01 | 1.00 | 0.99 | 0.81 | 1.06 | 0.94 |
| PC (38:7) [M+H]+ | ME242683 | 1.07 | 1.11 | 1.12 | 0.82 | 1.03 | 0.99 | 0.37 | 1.23 | 0.54 |
| DG (36:3) [M+Na]+ | ME242585 | 0.73 | 1.15 | 1.15 | 0.75 | 0.98 | 1.10 | 0.51 | 1.10 | 1.25 |
| PC (38:1) [M+H]+ | ME242672 | 0.97 | 1.03 | 1.04 | 0.96 | 0.99 | 1.05 | 0.71 | 1.04 | 0.93 |
| Cer (d40:1) [M+H]+ | ME242541 | 0.97 | 1.05 | 1.08 | 0.91 | 0.99 | 0.98 | 0.67 | 1.05 | 1.03 |
| PC (36:5) D [M+H]+ | ME242666 | 0.85 | 0.93 | 0.92 | 1.05 | 1.07 | 1.09 | 0.64 | 1.21 | 0.88 |
| CE (18:1) [M+NH4]+ | ME242478 | 1.10 | 0.99 | 1.02 | 1.04 | 0.93 | 1.00 | 0.87 | 1.02 | 0.84 |
| PE (36:2) [M+H]+ | ME242724 | 0.82 | 1.07 | 1.03 | 0.89 | 1.12 | 1.07 | 0.68 | 1.11 | 0.87 |
| 1_DG (12:0/12:0/0:0) [M+NH4]+ ISTD | ME242425 | 0.98 | 1.01 | 0.98 | 1.00 | 0.99 | 1.00 | 1.06 | 1.04 | 1.02 |
| PE (p-36:1) or PE (o-36:2) [M+H]+ | ME242729 | 0.94 | 0.94 | 1.09 | 0.94 | 1.03 | 1.09 | 0.69 | 1.05 | 0.90 |
Factors:
| F1 | Phenotype:CF | Collection Time (hours):0-h |
| F2 | Phenotype:CF | Collection Time (hours):2-h |
| F3 | Phenotype:CF | Collection Time (hours):4-h |
| F4 | Phenotype:GF | Collection Time (hours):0-h |
| F5 | Phenotype:GF | Collection Time (hours):2-h |
| F6 | Phenotype:GF | Collection Time (hours):4-h |
| F7 | Phenotype:NIST | Collection Time (hours):NIST |
| F8 | Phenotype:QC | Collection Time (hours):QC |
| F9 | Phenotype:Rep | Collection Time (hours):Rep |