Accord 08271317192D 72 73 0 0 0 0 0 0 0 0999 V2000 23.8585 7.6084 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 23.1695 8.0050 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 22.4803 7.6084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2568 6.9194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.4601 6.9194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 24.5477 8.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7384 6.5121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7384 5.7152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.0494 6.9101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.5446 8.6547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.7854 8.6699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.3553 6.5121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6608 6.9101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9663 6.5121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2719 6.9101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5775 6.5121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7855 8.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0911 7.6084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3966 8.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7021 7.6084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0075 8.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3132 7.6084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6186 8.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9241 7.6084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5775 5.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9241 6.9264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1631 6.4871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4022 6.9264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6412 6.4871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8802 6.9264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1194 6.4871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8232 5.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0689 5.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3145 5.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5602 5.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8059 5.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0516 5.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2973 5.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5430 5.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7887 5.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0344 5.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2801 5.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5258 5.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7715 5.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0172 5.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2629 5.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5086 5.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7543 5.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 5.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5525 10.1313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.9223 9.8890 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 23.0368 10.1422 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 22.1458 9.9087 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 21.6852 10.7064 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 22.5708 10.4534 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 22.1590 10.6912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1453 9.7428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.4748 10.0886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1901 10.4206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.4619 10.6867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.6393 11.0137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.5600 10.1782 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 19.6744 10.4315 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 18.7835 10.1980 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 18.3229 10.9957 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 19.2085 10.7426 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 18.7966 10.9804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6861 11.3030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1125 10.3778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8278 10.7099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.0995 10.9760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.1108 11.3030 0.0000 O 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 8 2 0 0 0 0 7 9 1 0 0 0 0 7 5 1 0 0 0 0 2 10 1 1 0 0 0 2 11 1 6 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 3 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 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 16 25 1 0 0 0 0 24 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 25 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 6 50 1 0 0 0 0 51 52 1 1 0 0 0 53 52 1 1 0 0 0 54 53 1 1 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 55 60 1 0 0 0 0 51 60 1 0 0 0 0 52 57 1 0 0 0 0 53 58 1 0 0 0 0 54 59 1 0 0 0 0 56 61 1 0 0 0 0 50 51 1 0 0 0 0 62 63 1 1 0 0 0 64 63 1 1 0 0 0 65 64 1 1 0 0 0 65 66 1 0 0 0 0 66 67 1 0 0 0 0 66 71 1 0 0 0 0 62 71 1 0 0 0 0 63 68 1 0 0 0 0 64 69 1 0 0 0 0 65 70 1 0 0 0 0 67 72 1 0 0 0 0 59 62 1 0 0 0 0 M END > LMSP0501AD06 > > Manbeta1-4Glcbeta-Cer(d18:1/26:0) > C56H107NO13 > 1001.77 > Sphingolipids [SP] > Neutral glycosphingolipids [SP05] > Simple Glc series [SP0501] > - > > - > - > - > - > - > - > - > - > - > 44260161 > - > - > Active (generated by computational methods) > - $$$$