Clustering data with hclust algorithm for (Study ST001363)
(Analysis AN002269)| Metabolite | Structure | F1 | F2 | F3 | F4 | F5 | F6 |
|---|---|---|---|---|---|---|---|
| Alkenyl-TG(P-50:1) | ME316754 | 1.01 | 0.99 | 0.94 | 1.07 | 1.05 | 0.93 |
| Cer[NDS](d18:0_24:1) | ME316640 | 0.82 | 0.93 | 0.73 | 1.15 | 1.26 | 1.11 |
| Cer[NS](d36:2) | ME316466 | 1.04 | 1.04 | 0.98 | 0.96 | 0.98 | 0.99 |
| DG(36:2) | ME316589 | 1.02 | 1.03 | 0.95 | 1.03 | 1.00 | 0.96 |
| D5TG(58:3) | ME316760 | 1.01 | 0.99 | 0.90 | 1.11 | 1.08 | 0.92 |
| LysoPS(18:0) | ME316255 | 1.05 | 1.03 | 0.72 | 1.22 | 1.20 | 0.79 |
| PC(16:1_18:2) | ME316336 | 1.02 | 1.01 | 0.93 | 1.05 | 1.04 | 0.94 |
| CL(68:4) | ME316690 | 1.03 | 1.02 | 0.87 | 1.13 | 1.11 | 0.84 |
| DG(17:0_18:1) | ME316609 | 1.00 | 0.98 | 0.91 | 1.13 | 1.06 | 0.93 |
| LysoPE(16:1) | ME316244 | 1.08 | 1.09 | 0.95 | 1.00 | 1.01 | 0.87 |
| PC(16:1_20:5) | ME316273 | 0.53 | 0.35 | 1.92 | 0.06 | 0.12 | 3.01 |
| BMP(42:9) | ME316271 | 1.07 | 1.05 | 0.94 | 1.00 | 1.00 | 0.95 |
| Alkenyl-TG(P-52:0) | ME316781 | 0.99 | 0.92 | 0.91 | 1.16 | 1.12 | 0.90 |
| HexCer[NS](d42:2) | ME316599 | 0.99 | 0.98 | 0.92 | 1.12 | 1.07 | 0.93 |
| Alkenyl-TG(P-50:0) | ME316771 | 0.98 | 0.95 | 0.91 | 1.15 | 1.10 | 0.91 |
| CL(68:6) | ME316667 | 1.03 | 1.03 | 0.83 | 1.18 | 1.14 | 0.80 |
| CE(18:1) | ME316757 | 1.03 | 1.01 | 0.96 | 1.02 | 1.02 | 0.96 |
| LysoPC(26:1) | ME316279 | 1.00 | 0.99 | 0.88 | 1.17 | 1.11 | 0.86 |
| D5TG(54:1) | ME316752 | 1.00 | 0.98 | 0.95 | 1.07 | 1.06 | 0.94 |
| AC(16:0) | ME316250 | 1.06 | 1.06 | 0.91 | 1.10 | 1.07 | 0.80 |
| Cer[NS](d36:1) | ME316534 | 0.98 | 0.97 | 0.91 | 1.13 | 1.08 | 0.92 |
| CL(70:7) | ME316669 | 1.04 | 1.02 | 0.82 | 1.19 | 1.16 | 0.77 |
| HexCer[NS](d41:2) | ME316571 | 0.99 | 0.98 | 0.88 | 1.17 | 1.10 | 0.89 |
| CE(16:0) | ME316758 | 1.02 | 0.99 | 0.91 | 1.09 | 1.11 | 0.89 |
| CL(71:5) | ME316701 | 1.04 | 1.02 | 0.79 | 1.23 | 1.20 | 0.72 |
| PA(34:1) | ME316458 | 1.01 | 1.00 | 0.87 | 1.13 | 1.10 | 0.88 |
| LysoPC(16:1) | ME316243 | 1.06 | 1.04 | 1.01 | 1.00 | 0.98 | 0.91 |
| DG(16:0_16:0) | ME316581 | 1.01 | 0.99 | 0.89 | 1.14 | 1.10 | 0.89 |
| Cer[NS](d34:2) | ME316428 | 0.98 | 0.98 | 0.91 | 1.12 | 1.09 | 0.93 |
| CL(71:6) | ME316688 | 1.05 | 1.04 | 0.77 | 1.24 | 1.20 | 0.70 |
| DG(16:0_24:1) | ME316671 | 0.96 | 0.95 | 0.90 | 1.19 | 1.11 | 0.89 |
| CL(64:3) | ME316674 | 1.03 | 1.02 | 0.81 | 1.20 | 1.17 | 0.76 |
| HexCer[NS](d44:2) | ME316641 | 0.97 | 0.95 | 0.87 | 1.19 | 1.15 | 0.87 |
| CE(20:5) | ME316714 | 1.07 | 1.09 | 0.87 | 1.04 | 1.05 | 0.89 |
| PC(17:1_20:4) | ME316346 | 1.01 | 0.97 | 0.71 | 1.19 | 1.14 | 0.98 |
| CE(20:4) | ME316729 | 1.07 | 1.06 | 0.96 | 0.98 | 0.97 | 0.96 |
| CE(24:1) | ME316794 | 1.00 | 0.94 | 0.82 | 1.27 | 1.18 | 0.80 |
| Cer[NS](d35:1) | ME316495 | 1.00 | 0.96 | 0.88 | 1.16 | 1.10 | 0.89 |
| DG(33:1) | ME316555 | 1.00 | 0.97 | 0.92 | 1.12 | 1.05 | 0.93 |
| Cer[NS](d43:2) | ME316655 | 0.99 | 0.98 | 0.91 | 1.13 | 1.08 | 0.92 |
| Alkenyl-TG(P-18:0_16:0_18:1) | ME316770 | 1.00 | 0.98 | 0.90 | 1.14 | 1.11 | 0.88 |
| PC(14:0_14:0) | ME316295 | 0.99 | 0.98 | 0.93 | 1.11 | 1.07 | 0.92 |
| BMP(32:1) | ME316285 | 0.98 | 0.98 | 0.87 | 1.18 | 1.12 | 0.87 |
| DG(32:1) | ME316522 | 1.03 | 1.02 | 0.93 | 1.06 | 1.03 | 0.94 |
| DG(16:0_18:1) | ME316585 | 1.00 | 0.99 | 0.92 | 1.10 | 1.06 | 0.92 |
| DG(36:3) | ME316539 | 1.00 | 1.01 | 0.96 | 1.08 | 1.01 | 0.94 |
| BMP(40:6) | ME316323 | 1.02 | 1.02 | 0.87 | 1.09 | 1.09 | 0.90 |
| CL(67:4) | ME316682 | 1.04 | 1.03 | 0.82 | 1.19 | 1.15 | 0.77 |
| DG(18:1_22:5) | ME316496 | 1.08 | 0.99 | 0.91 | 1.07 | 1.09 | 0.86 |
| D5TG(54:3) | ME316736 | 1.01 | 1.00 | 0.94 | 1.08 | 1.03 | 0.95 |
| Cer[NDS](d19:0_24:1) | ME316665 | 1.02 | 0.85 | 0.84 | 0.97 | 1.23 | 1.07 |
| LysoPI(18:1) | ME316246 | 1.28 | 1.27 | 0.30 | 1.48 | 1.43 | 0.24 |
| Alkenyl-TG(P-48:0) | ME316753 | 1.00 | 0.98 | 0.93 | 1.10 | 1.07 | 0.92 |
| CE(22:6) | ME316720 | 1.06 | 1.04 | 0.97 | 0.98 | 0.98 | 0.97 |
| HexCer[NS](d42:3) | ME316551 | 1.01 | 1.02 | 0.90 | 1.12 | 1.06 | 0.89 |
| Cer[NS](d40:1) | ME316645 | 0.99 | 0.98 | 0.93 | 1.09 | 1.06 | 0.94 |
| Cer[NS](d18:1_16:0) | ME316431 | 1.00 | 1.02 | 0.80 | 1.21 | 1.16 | 0.82 |
| LysoPC(18:1) | ME316252 | 1.03 | 1.02 | 0.98 | 1.02 | 1.00 | 0.95 |
| HexCer[NS](d42:1) | ME316648 | 0.99 | 0.98 | 0.92 | 1.09 | 1.09 | 0.93 |
| HexCer[NS](d40:1) | ME316601 | 0.99 | 0.97 | 0.91 | 1.12 | 1.09 | 0.92 |
| DG(42:2) | ME316673 | 0.97 | 0.97 | 0.93 | 1.16 | 1.06 | 0.90 |
| Cer[NDS](d18:1_22:0) | ME316631 | 1.04 | 0.98 | 0.91 | 1.08 | 1.12 | 0.88 |
| Cer[NDS](d17:1_24:1) | ME316606 | 1.14 | 1.03 | 0.94 | 0.92 | 1.05 | 0.93 |
| PA(16:0_18:1) | ME316439 | 1.05 | 1.05 | 0.80 | 1.18 | 1.18 | 0.73 |
| DG(17:1_18:1) | ME316560 | 1.04 | 1.01 | 0.97 | 1.03 | 0.98 | 0.97 |
| Cer[ADS](d18:1_24:0) | ME316597 | 0.96 | 1.02 | 0.99 | 1.01 | 1.03 | 1.00 |
| LysoPE(16:0) | ME316251 | 1.03 | 1.02 | 0.89 | 1.13 | 1.09 | 0.84 |
| CL(68:2) | ME316718 | 1.04 | 1.03 | 0.83 | 1.19 | 1.17 | 0.74 |
| LysoPI(18:0) | ME316253 | 1.23 | 1.21 | 0.43 | 1.41 | 1.39 | 0.34 |
| DG(36:1) | ME316632 | 0.99 | 0.97 | 0.91 | 1.13 | 1.08 | 0.92 |
| LysoPC(18:0) | ME316256 | 1.01 | 1.01 | 0.91 | 1.11 | 1.07 | 0.90 |
| PC(16:0_24:1) | ME316623 | 0.98 | 0.98 | 0.92 | 1.11 | 1.09 | 0.92 |
| Cer[NS](d43:1) | ME316666 | 0.99 | 0.98 | 0.91 | 1.12 | 1.08 | 0.92 |
| LysoPC(24:0) | ME316280 | 0.98 | 0.98 | 0.87 | 1.20 | 1.13 | 0.84 |
| LysoPE(20:1) | ME316259 | 1.08 | 1.06 | 0.91 | 1.05 | 1.04 | 0.86 |
| CE(20:2) | ME316759 | 1.06 | 1.04 | 0.98 | 0.97 | 0.98 | 0.96 |
| Cer[NS](d44:1) | ME316679 | 0.98 | 0.99 | 0.94 | 1.10 | 1.06 | 0.94 |
| PC(16:0_20:5) | ME316321 | 1.03 | 1.03 | 0.90 | 1.08 | 1.07 | 0.89 |
| DG(18:1_20:1) | ME316635 | 1.01 | 1.00 | 0.93 | 1.08 | 1.04 | 0.94 |
| CL(18:1_18:1_16:1_18:1) | ME316703 | 1.03 | 1.02 | 0.86 | 1.16 | 1.14 | 0.80 |
| CL(18:1_18:1_18:2_18:1) | ME316706 | 1.03 | 1.03 | 0.84 | 1.17 | 1.15 | 0.78 |
| PC(18:0_20:3) | ME316506 | 1.00 | 0.99 | 0.93 | 1.10 | 1.06 | 0.93 |
| Cer[NDS](d44:1) | ME316672 | 0.96 | 0.98 | 0.94 | 1.09 | 1.08 | 0.94 |
| DG(14:0_16:0) | ME316513 | 1.01 | 1.00 | 0.90 | 1.11 | 1.08 | 0.90 |
| Cer[NDS](d18:0_20:1) | ME316587 | 1.05 | 1.02 | 0.96 | 0.99 | 1.04 | 0.94 |
| HexCer[NS](d41:1) | ME316624 | 0.99 | 0.98 | 0.90 | 1.13 | 1.10 | 0.91 |
| Cer[NDS](d40:2) | ME316590 | 1.07 | 1.03 | 0.97 | 0.96 | 1.04 | 0.94 |
| Cer[NS](d42:3) | ME316600 | 1.02 | 1.00 | 0.96 | 1.05 | 1.02 | 0.96 |
| Cer[NDS](d39:1) | ME316608 | 1.07 | 0.97 | 0.90 | 1.10 | 1.14 | 0.83 |
| PC(14:0_20:5) | ME316277 | 1.02 | 1.03 | 0.96 | 1.03 | 1.01 | 0.95 |
| Cer[NDS](d18:2_20:0) | ME316528 | 1.10 | 1.05 | 0.95 | 0.95 | 1.04 | 0.91 |
| BMP(34:2) | ME316291 | 1.01 | 1.03 | 0.95 | 1.03 | 1.03 | 0.96 |
| HexCer[NS](d36:1) | ME316468 | 1.00 | 0.99 | 0.90 | 1.11 | 1.09 | 0.90 |
| Alkanyl-TG(O-54:1) | ME316787 | 0.98 | 0.92 | 0.91 | 1.18 | 1.13 | 0.89 |
| Cer[NS](d41:2) | ME316620 | 0.99 | 0.98 | 0.92 | 1.10 | 1.06 | 0.93 |
| HexCer[NS](d39:1) | ME316577 | 1.01 | 1.00 | 0.93 | 1.09 | 1.07 | 0.90 |
| AC(14:0) | ME316242 | 1.06 | 1.02 | 0.96 | 1.04 | 1.03 | 0.89 |
| CL(18:1_18:1_17:1_18:1) | ME316710 | 1.05 | 1.04 | 0.76 | 1.26 | 1.22 | 0.68 |
| LysoPE(20:0) | ME316261 | 1.00 | 0.99 | 0.74 | 1.29 | 1.22 | 0.75 |
| Cer[NS](d33:1) | ME316419 | 0.99 | 0.98 | 0.93 | 1.09 | 1.08 | 0.93 |
| CL(16:1_16:1_14:0_16:1) | ME316664 | 1.05 | 1.03 | 0.73 | 1.27 | 1.22 | 0.70 |
| CL(69:4) | ME316695 | 1.04 | 1.02 | 0.82 | 1.19 | 1.15 | 0.78 |
| Cer[NS](d42:1) | ME316652 | 1.01 | 0.99 | 0.93 | 1.07 | 1.07 | 0.93 |
| Cer[NS](d42:2) | ME316649 | 1.00 | 0.99 | 0.95 | 1.07 | 1.03 | 0.95 |
| CL(69:5) | ME316685 | 1.04 | 1.03 | 0.81 | 1.20 | 1.16 | 0.76 |
| BMP(44:1)2) | ME316267 | 1.03 | 1.04 | 0.96 | 1.01 | 1.00 | 0.96 |
| Cer[NDS](d18:1_26:1) | ME316661 | 1.08 | 1.03 | 0.95 | 0.99 | 1.06 | 0.90 |
| LysoPC(20:0) | ME316260 | 0.99 | 0.99 | 0.88 | 1.19 | 1.12 | 0.83 |
| Cer[NS](d18:1_24:1) | ME316628 | 1.03 | 0.97 | 0.97 | 0.95 | 1.02 | 1.05 |
| Cer[NS](d40:3) | ME316545 | 1.03 | 1.02 | 0.87 | 1.12 | 1.07 | 0.89 |
| DG(16:0_18:0) | ME316634 | 0.95 | 0.93 | 0.91 | 1.21 | 1.13 | 0.87 |
| Cer[NDS](d18:1_23:0) | ME316650 | 0.96 | 0.86 | 0.89 | 1.00 | 1.06 | 1.22 |
| LysoPE(18:1) | ME316254 | 1.05 | 1.05 | 0.96 | 1.01 | 1.01 | 0.91 |
| Cer[NDS](d18:0_23:0) | ME316658 | 0.81 | 0.80 | 1.44 | 1.06 | 0.93 | 0.95 |
| Cer[NDS](d18:2_18:0) | ME316455 | 1.07 | 1.03 | 0.99 | 0.92 | 0.91 | 1.08 |
| CL(70:5) | ME316691 | 1.03 | 1.02 | 0.87 | 1.14 | 1.12 | 0.83 |
| BMP(38:7) | ME316269 | 1.05 | 1.04 | 0.95 | 1.01 | 1.00 | 0.95 |
| LysoPE(24:0) | ME316288 | 0.99 | 0.98 | 0.83 | 1.23 | 1.17 | 0.81 |
| LysoPC(20:1) | ME316258 | 1.06 | 1.04 | 0.94 | 1.04 | 1.02 | 0.90 |
| Cer[NS](d44:2) | ME316663 | 0.98 | 0.98 | 0.91 | 1.13 | 1.08 | 0.91 |
| LysoPS(16:0) | ME316245 | 1.24 | 1.22 | 0.30 | 1.48 | 1.45 | 0.30 |
| Cer[NS](d39:2) | ME316568 | 0.99 | 0.98 | 0.88 | 1.18 | 1.08 | 0.88 |
| DG(34:2) | ME316526 | 1.03 | 1.02 | 0.93 | 1.04 | 1.02 | 0.96 |
| LysoPE(22:0) | ME316265 | 0.99 | 0.98 | 0.81 | 1.24 | 1.18 | 0.81 |
| Cer[NS](d37:1) | ME316570 | 0.98 | 0.97 | 0.89 | 1.15 | 1.10 | 0.91 |
| Cer[NDS](d18:1_18:0) | ME316520 | 1.08 | 1.04 | 1.00 | 0.91 | 1.01 | 0.96 |
| HexCer[NS](d43:1) | ME316657 | 0.99 | 0.95 | 0.86 | 1.19 | 1.13 | 0.89 |
| Cer[NS](d38:1) | ME316598 | 0.98 | 0.98 | 0.92 | 1.12 | 1.07 | 0.93 |
| Cer[NS](d44:3) | ME316647 | 1.02 | 1.01 | 0.94 | 1.08 | 1.01 | 0.94 |
| PC(16:0_22:6) | ME316353 | 0.99 | 1.00 | 0.95 | 1.06 | 1.03 | 0.96 |
| Cer[NS](d38:2) | ME316546 | 1.01 | 1.00 | 0.91 | 1.10 | 1.06 | 0.92 |
| LysoPC(24:1) | ME316263 | 1.02 | 1.01 | 0.92 | 1.10 | 1.05 | 0.89 |
| PC(17:1_18:1) | ME316422 | 1.02 | 1.02 | 0.96 | 1.02 | 1.02 | 0.96 |
| DG(40:2) | ME316662 | 1.04 | 1.00 | 0.93 | 1.10 | 1.03 | 0.91 |
| BMP(38:4) | ME316306 | 1.04 | 1.04 | 0.93 | 1.04 | 1.02 | 0.93 |
| HexCer[NS](d40:2) | ME316541 | 0.97 | 0.96 | 0.86 | 1.21 | 1.12 | 0.87 |
| CL(68:5) | ME316677 | 1.03 | 1.02 | 0.86 | 1.14 | 1.12 | 0.83 |
| CL(66:4) | ME316675 | 1.03 | 1.02 | 0.86 | 1.14 | 1.12 | 0.83 |
| HexCer[NS](d34:1) | ME316397 | 1.00 | 0.99 | 0.92 | 1.09 | 1.08 | 0.92 |
| CL(67:5) | ME316670 | 1.05 | 1.04 | 0.77 | 1.23 | 1.19 | 0.72 |
| CL(70:6) | ME316680 | 1.03 | 1.02 | 0.85 | 1.16 | 1.13 | 0.81 |
| BMP(36:2) | ME316358 | 1.01 | 1.02 | 0.90 | 1.09 | 1.05 | 0.93 |
| Cer[NS](d39:1) | ME316621 | 0.99 | 0.98 | 0.92 | 1.12 | 1.08 | 0.92 |
| Cer[NS](d40:2) | ME316592 | 1.00 | 0.99 | 0.92 | 1.11 | 1.06 | 0.93 |
| LysoPS(18:1) | ME316248 | 1.28 | 1.27 | 0.35 | 1.41 | 1.37 | 0.32 |
| BMP(40:7) | ME316283 | 1.04 | 1.03 | 0.96 | 1.01 | 1.00 | 0.96 |
| LysoPE(18:0) | ME316257 | 1.02 | 1.01 | 0.88 | 1.14 | 1.11 | 0.84 |
| LysoPE(24:1) | ME316266 | 1.00 | 1.00 | 0.87 | 1.17 | 1.10 | 0.85 |
| HexCer[NS](d38:1) | ME316544 | 0.98 | 0.96 | 0.87 | 1.18 | 1.13 | 0.88 |
| BMP(38:6) | ME316278 | 1.00 | 0.99 | 0.90 | 1.12 | 1.07 | 0.91 |
| LysoPG(18:1) | ME316247 | 1.13 | 1.04 | 0.86 | 1.07 | 1.05 | 0.85 |
| LysoPC(22:0) | ME316262 | 0.99 | 0.98 | 0.86 | 1.22 | 1.14 | 0.81 |
| Cer[NS](d41:1) | ME316638 | 1.01 | 0.98 | 0.89 | 1.15 | 1.09 | 0.89 |
| CL(72:6) | ME316693 | 1.04 | 1.03 | 0.85 | 1.16 | 1.13 | 0.79 |
| Alkanyl-TG(O-16:0_16:0_16:0) | ME316772 | 0.97 | 0.89 | 0.95 | 1.17 | 1.11 | 0.91 |
| Cer[NDS](d18:1_24:0) | ME316660 | 0.98 | 0.91 | 0.93 | 1.00 | 1.06 | 1.12 |
| PC(16:1_17:1) | ME316356 | 1.02 | 1.01 | 0.94 | 1.05 | 1.04 | 0.93 |
| Alkenyl-TG(P-54:1) | ME316780 | 1.03 | 0.94 | 0.92 | 1.14 | 1.13 | 0.85 |
| CL(16:1_17:1_16:1_16:1) | ME316668 | 1.05 | 1.03 | 0.77 | 1.24 | 1.19 | 0.72 |
| CE(26:1) | ME316799 | 0.94 | 0.90 | 0.77 | 1.39 | 1.27 | 0.74 |
| CE(26:2) | ME316793 | 1.08 | 0.93 | 0.81 | 1.23 | 1.26 | 0.70 |
Factors:
| F1 | Solvent:BuMe |
| F2 | Solvent:BuMe_scr |
| F3 | Solvent:CHCl3 |
| F4 | Solvent:IPA |
| F5 | Solvent:IPA_scr |
| F6 | Solvent:MTBE |