LMSL03001279 LIPID_MAPS_STRUCTURE_DATABASE 85 86 0 0 0 999 V2000 -1.7265 1.9568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7265 2.7530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5753 1.4668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6718 -1.1861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6718 -2.0350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5413 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4108 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2802 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1496 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0191 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8886 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7580 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6275 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4969 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3663 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2358 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1053 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9747 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8442 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7137 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5830 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.4525 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3220 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.1915 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.0609 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.9304 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.7998 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.6692 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.5387 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -22.4082 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -23.2776 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -24.1471 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -25.0166 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -25.8859 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -26.7554 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -27.6249 -0.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2802 0.0497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0191 0.0497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7580 0.0497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4969 0.0497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2358 0.0497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9747 0.0497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8442 -2.0453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4448 2.0939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3143 1.6039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1837 2.0939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0532 1.6039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9227 2.0939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7921 1.6039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6615 2.0939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5310 1.6039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4004 2.0939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2699 1.6039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1394 2.0939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0088 1.6039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8782 2.0939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7477 1.6039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3747 5.2918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0274 6.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1699 6.5821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1464 3.8885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4557 5.4798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0695 4.0769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6965 5.1015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4004 5.9380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4714 5.7477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8445 4.7232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9156 4.5328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7674 1.4156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1685 -0.5547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3376 -0.7263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0259 2.1382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8598 0.0165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9363 2.2273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3173 1.3298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7876 0.3428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8721 0.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4912 1.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5759 1.0690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4695 3.2119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8805 4.8953 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5490 5.4034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1314 4.2533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4688 4.4137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5542 0.1478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 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 16 17 1 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 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 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 8 37 1 6 0 0 0 10 38 1 6 0 0 0 12 39 1 6 0 0 0 14 40 1 6 0 0 0 16 41 1 6 0 0 0 18 42 1 6 0 0 0 19 43 1 0 0 0 0 3 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 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 62 68 1 0 0 0 67 61 1 0 0 0 61 63 1 0 0 0 63 64 1 0 0 0 64 65 1 0 0 0 65 66 1 0 0 0 66 67 1 0 0 0 67 68 1 1 0 0 64 58 1 6 0 0 65 59 1 1 0 0 66 60 1 6 0 0 73 79 1 0 0 0 78 72 1 0 0 0 72 74 1 0 0 0 74 75 1 0 0 0 75 76 1 0 0 0 76 77 1 0 0 0 77 78 1 0 0 0 78 79 1 6 0 0 75 69 1 1 0 0 76 70 1 6 0 0 77 71 1 1 0 0 74 80 1 1 0 0 63 80 1 6 0 0 81 82 2 0 0 0 0 81 83 2 0 0 0 0 81 84 1 0 0 0 0 58 81 1 0 0 0 0 69 1 1 0 0 0 0 70 4 1 0 0 0 0 6 85 1 6 0 0 M END > LMSL03001279 > AC2SGL(16:0/32:0(2Me[S],4Me[S],6Me[S],8Me[S],10Me[R],12Me[R],14Me[R],15OH)) > 2-O-hexadecanoyl,3-O-(2S,4S,6S,8R,10R,12R,14R-heptamethyl)-15-hydroxy-dotriacontanoyl)-2'-sulfotrehalose > C67H128O17S > 1236.89 > Saccharolipids [SL] > Acyltrehaloses [SL03] > > - > > - > - > - > - > - > - > - > - > - > 126457720 > - > - > Active (generated by computational methods) > - > https://lipidmaps.org/index.php/databases/lmsd/LMSL03001279 $$$$