LMSP05010203 LIPID_MAPS_STRUCTURE_DATABASE 56 56 0 0 0 999 V2000 18.4802 -3.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6141 -3.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7477 -3.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9809 -4.4547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9796 -4.4547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.3468 -3.0885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2131 -3.5886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0856 -2.2733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1314 -2.2541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8743 -3.0901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0012 -3.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1281 -3.0901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2551 -3.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3820 -3.0901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5090 -3.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6360 -3.0901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7628 -3.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8898 -3.0901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0167 -3.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1436 -3.0901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2706 -3.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3975 -3.0901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0918 -4.9472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0918 -5.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2242 -4.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3564 -4.9472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4884 -4.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6206 -4.9472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7527 -4.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8848 -4.9472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0170 -4.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1491 -4.9472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2813 -4.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4134 -4.9472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5455 -4.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6776 -4.9472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8097 -4.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9418 -4.9472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0739 -4.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2096 -4.9530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3419 -4.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4776 -4.9588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6099 -4.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3820 -2.0901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2493 -3.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.9534 -2.6002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.6798 -3.6134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.6631 -5.6103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.0693 -5.0961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.8624 -6.9424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.0750 -4.0929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9451 -3.5987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8097 -4.1077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8013 -5.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9312 -5.6002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9228 -6.5987 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 2 8 1 1 0 0 0 2 9 1 6 0 0 0 3 10 2 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 2 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 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 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 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 5 23 1 0 0 0 0 39 40 1 0 0 0 40 41 1 0 0 0 41 42 1 0 0 0 42 43 1 0 0 0 14 44 1 0 0 0 25 45 1 1 0 0 50 56 1 0 0 0 55 49 1 0 0 0 49 51 1 0 0 0 51 52 1 0 0 0 52 53 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 55 56 1 1 0 0 51 7 1 1 0 0 52 46 1 6 0 0 53 47 1 1 0 0 54 48 1 6 0 0 M END > LMSP05010203 > Aspercerebroside A > N-(2R-hydroxy-eicosenoyl)-1-beta-glucopyranosyl-9methyl-sphinga-4E,8E-dienine > C44H81NO9 > 767.59 > Sphingolipids [SP] > Neutral glycosphingolipids [SP05] > Simple Glc series [SP0501] > - > (2R,3E)-N-((2S,3R,4E,8E)-3-hydroxy-9-methyl-1-(beta-D-glucopyranosyloxy) 2-hydroxyheptadeca-4,8-dien-2-yl))icos-3-enamide > QKXHBVZUPUPZGE-XLYZAPMLSA-N > InChI=1S/C44H81NO9/c1-4-6-8-10-12-13-14-15-16-17-18-19-20-21-23-27-32-38(48)43(52)45-36(34-53-44-42(51)41(50)40(49)39(33-46)54-44)37(47)31-28-24-26-30-35(3)29-25-22-11-9-7-5-2/h27-28,30-32,36-42,44,46-51H,4-26,29,33-34H2,1-3H3,(H,45,52)/b31-28+,32-27+,35-30+/t36-,37+,38+,39+,40+,41-,42+,44+/m0/s1 > [C@](CO[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)([H])(NC([C@H](O)/C=C/CCCCCCCCCCCCCCCC)=O)[C@]([H])(O)/C=C/CC/C=C(\C)/CCCCCCCC > - > - > - > HexCer 38:3;O3 > - > - > - > - > - > - > - > - > 5065 > 38392991 $$$$