metabolite_name SCr-D1 KD-D1 SCr-D2 KD-D2 SCr-D3 KD-D3 SM(40:2) 17.20193205 29.92518117 17.13790764 30.84444737 31.18175593 16.6790407 SM(d39:1) 15.38197985 21.49159303 10.31057802 19.69177511 5.310709225 24.27979387 SM(d42:3) 45.39569106 80.55755523 47.76495437 89.8564094 106.0340446 38.43533259 SM(d34:2) 13.42104561 20.56499258 13.92247586 21.65716417 20.5471264 10.03529777 SM(d18:0/14:0) 4.349973139 6.253309045 4.631394023 7.272072629 6.791737851 3.835228151 SM(d18:1/16:0) 1304.095013 2122.820665 1269.762231 2318.336646 2209.709313 1537.240129 SM(d18:1/24:0) 141.8925289 216.5551407 122.029665 260.1155001 158.6334128 182.1644583 SM(d18:2/24:1) 1.544120503 2.486120427 1.59401539 3.413540223 2.999495106 1.042457274 SM(d32:1) 46.45775613 67.64853456 46.50944152 70.63184664 79.71227573 45.28629093 SM(d33:1) 12.41136815 16.410371 9.863641453 19.59395256 12.384952 17.05606495 SM(d36:1) 127.1885507 187.3470347 111.4172698 216.4558915 146.6283841 144.5802687 SM(d36:2) 7.312437134 11.58058873 6.561771229 8.85432372 7.673800181 7.391628972 SM(d38:2) 2.219475046 3.276988432 2.708171565 3.966326677 5.706922752 2.080261274 SM(d40:1) 147.964426 237.8186666 147.5238876 288.3692518 163.594511 219.4377597 SM(d41:1) 35.13400258 40.66125672 25.71612436 36.95160133 18.61520159 49.42096797 SM(d42:1) 11.55854829 20.9532022 13.78408087 24.36419072 18.10161024 10.42244865 SM(d42:2) 174.692472 311.313033 193.3236548 370.87741 391.5863064 168.6153408 metabolite_name quantified m/z RT(minutes) PubChem ID KEGG ID SM(40:2) 785.6485519 6.743978333 SM(d39:1) 773.6486401 7.003965 SM(d42:3) 811.6639938 6.739763333 SM(d34:2) 701.5547943 5.495344167 SM(d18:0/14:0) 677.5545912 5.536829167 SM(d18:1/16:0) 705.5847473 6.077355833 SM(d18:1/24:0) 815.6952006 7.538965833 SM(d18:2/24:1) 811.6638714 6.525891667 SM(d32:1) 675.5390422 5.327025833 SM(d33:1) 689.5547545 5.609240833 SM(d36:1) 731.6017965 6.380199167 SM(d36:2) 729.5850214 5.895625 SM(d38:2) 757.6174533 6.373169167 SM(d40:1) 787.6641947 7.1947175 SM(d41:1) 801.6798416 7.372094167 SM(d42:1) 815.694201 7.2714375 SM(d42:2) 813.6797969 7.122323333