LMST01040212 LIPID_MAPS_STRUCTURE_DATABASE 67 71 0 0 0 999 V2000 20.6732 9.0930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.0539 9.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0539 10.3766 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.3592 9.2441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6644 9.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9696 9.2441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2747 9.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5799 9.2441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8851 9.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1904 9.2441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4955 9.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8008 9.2441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1060 9.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4111 9.2441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7164 9.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0216 9.2441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3268 9.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6320 9.2441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0422 9.5912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3260 9.1865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6720 9.5602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9871 9.1243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2062 8.2997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2062 7.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.1733 6.6002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.1733 8.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.1528 7.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1393 6.6038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.1005 7.1350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.1528 8.2997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.0987 8.3556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.1118 10.5943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1211 10.0168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1314 8.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.1124 10.0281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.1082 8.8840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.1026 8.8943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.0926 10.0214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.1043 10.6005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2366 6.4395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.1424 9.2468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.1146 9.2592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 29.1042 10.9642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1284 7.9575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 29.1072 7.9983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 30.1091 11.6585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.6736 11.1508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 29.2904 12.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.0123 12.3359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.0854 11.6585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.1015 12.3359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.1740 11.6585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.1740 10.5012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.1621 12.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.0867 12.5089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 33.1011 13.2783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.0683 13.8367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2236 4.7133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.2220 4.7276 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.2379 6.4653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.7414 7.3169 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.2381 6.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7316 5.5822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7283 5.5907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2364 6.4595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7429 7.3225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2509 8.1914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 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 23 26 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 27 1 0 0 0 0 30 26 1 0 0 0 0 27 30 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 34 30 1 0 0 0 0 31 34 1 0 0 0 0 31 36 1 0 0 0 0 35 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 35 36 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 35 1 0 0 0 0 36 37 1 0 0 0 0 30 41 1 1 0 0 0 31 42 1 1 0 0 0 35 43 1 1 0 0 0 34 44 1 6 0 0 0 36 45 1 6 0 0 0 31 29 1 0 0 0 0 24 40 1 1 0 0 0 39 46 1 0 0 0 0 39 47 1 6 0 0 0 46 48 1 6 0 0 0 46 49 1 0 0 0 0 49 50 2 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 52 54 1 0 0 0 0 51 56 1 1 0 0 0 46 55 1 1 0 0 0 56 57 1 0 0 0 0 66 61 1 0 0 0 61 62 1 0 0 0 62 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 1 0 0 62 40 1 1 0 0 63 58 1 6 0 0 64 59 1 1 0 0 65 60 1 6 0 0 67 1 1 0 0 0 M END > LMST01040212 > 20:0-Glc-Stigmasterol > 3-O-(6'-O-eicosanoyl-beta-D-glucopyranosyl)-stigmast-5,22E-dien-3beta-ol > C55H96O7 > 868.72 > Sterol Lipids [ST] > Sterols [ST01] > Stigmasterols and C24-ethyl derivatives [ST0104] > - > > RUCQBZOIQXMULS-WJBBYMNWSA-N > InChI=1S/C55H96O7/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-49(56)60-38-48-50(57)51(58)52(59)53(62-48)61-43-33-35-54(6)42(37-43)29-30-44-46-32-31-45(55(46,7)36-34-47(44)54)40(5)27-28-41(9-2)39(3)4/h27-29,39-41,43-48,50-53,57-59H,8-26,30-38H2,1-7H3/b28-27+/t40-,41-,43+,44+,45-,46+,47+,48-,50-,51+,52-,53-,54+,55-/m1/s1 > O(C[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@H](O[C@@H]2CC3=CC[C@@]4([H])[C@]5([H])CC[C@]([H])([C@@]([H])(/C=C/[C@@H](CC)C(C)C)C)[C@@]5(C)CC[C@]4([H])[C@@]3(C)CC2)O1)C(CCCCCCCCCCCCCCCCCCC)=O > - > - > - > - > - > - > 70699363 > - > - > - > - > - > - > - $$$$