LMSP03010105 LIPID_MAPS_STRUCTURE_DATABASE 63 62 0 0 0 999 V2000 -14.6511 -1.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5829 -0.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5148 -1.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1126 -1.9778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1897 -1.9778 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.7191 -0.5077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7871 -1.0459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4801 -1.0683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5484 -1.6063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6163 -1.0683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6844 -1.6063 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7524 -1.0683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6844 -2.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7524 -2.1443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4613 -0.6688 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -11.9360 -1.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4613 0.3123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.0756 0.3691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.1021 0.3897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.4543 -0.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.3936 -1.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.3325 -0.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.2718 -1.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.2111 -0.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -22.1503 -1.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -23.0893 -0.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -24.0285 -1.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -24.9680 -0.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -25.9071 -1.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -26.8462 -0.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -27.7853 -1.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -28.7246 -0.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -29.6638 -1.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3211 -3.0326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8055 -2.9518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1430 -1.3362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0889 -2.4673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7529 -0.3412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1964 -0.6913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7114 -3.4366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1932 -1.9303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2710 -3.1018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -32.9675 -2.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -32.0798 -1.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -31.1921 -2.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -30.3045 -1.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -29.4167 -2.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -28.5291 -1.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -27.6415 -2.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -26.7537 -1.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -25.8661 -2.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -24.9784 -2.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -24.0907 -1.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -23.2030 -2.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -22.3154 -1.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.4276 -2.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.5400 -1.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.6522 -2.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.7646 -1.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.8770 -2.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9892 -1.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1020 -3.5003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.1020 -2.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 1 5 1 6 0 0 0 1 4 1 1 0 0 0 6 1 1 0 0 0 0 7 6 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 11 10 1 0 0 0 0 12 11 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 15 8 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 15 7 1 0 0 0 0 2 18 1 1 0 0 0 2 19 1 6 0 0 0 3 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 13 34 1 0 0 0 14 35 1 0 0 0 14 37 1 0 0 0 12 36 1 0 0 0 12 38 1 0 0 0 12 39 1 0 0 0 13 40 1 0 0 0 14 41 1 0 0 0 13 42 1 0 0 0 44 43 1 0 0 0 0 45 44 1 0 0 0 0 46 45 1 0 0 0 0 47 46 1 0 0 0 0 48 47 1 0 0 0 0 49 48 1 0 0 0 0 50 49 1 0 0 0 0 51 50 1 0 0 0 0 52 51 2 0 0 0 0 53 52 1 0 0 0 0 54 53 1 0 0 0 0 55 54 1 0 0 0 0 56 55 1 0 0 0 0 57 56 1 0 0 0 0 58 57 1 0 0 0 0 59 58 1 0 0 0 0 60 59 1 0 0 0 0 61 60 1 0 0 0 0 63 61 1 0 0 0 0 63 62 2 0 0 0 0 5 63 1 0 0 0 0 M CHG 2 11 1 16 -1 M ISO 8 34 2 35 2 36 2 37 2 38 2 39 2 40 2 41 2 M ISO 1 42 2 M END > LMSP03010105 > SM(d18:1/20:1(11Z))-d9 > N-(11Z-eicosenoyl)-sphing-4-enine-1-phosphocholine-d9 > C43H76D9N2O6P > 765.67 > Sphingolipids [SP] > Phosphosphingolipids [SP03] > Ceramide phosphocholines (sphingomyelins) [SP0301] > - > N-eicos-11Z-enoyl-D-erythro-sphingosylphosphorylcholine-d9 > MDRFMTLYKHBJTF-YIUBPXDCSA-N > InChI=1S/C43H85N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-43(47)44-41(40-51-52(48,49)50-39-38-45(3,4)5)42(46)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2/h20-21,34,36,41-42,46H,6-19,22-33,35,37-40H2,1-5H3,(H-,44,47,48,49)/b21-20-,36-34+/t41-,42+/m0/s1/i3D3,4D3,5D3 > [C@](COP(=O)([O-])OCC[N+](C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])([H])(NC(=O)CCCCCCCCC/C=C\CCCCCCCC)[C@]([H])(O)/C=C/CCCCCCCCCCCCC > - > - > - > - > - > - > 146036830 > - > - > - > - > - > 32630 > - $$$$