LMST05020065 LIPID_MAPS_STRUCTURE_DATABASE 41 44 0 0 0 0 0 0 0 0999 V2000 14.7957 -7.8232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9383 -10.6342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9383 -11.6455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8112 -12.1461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8112 -10.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6844 -10.6342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6801 -11.6455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5489 -12.1521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4279 -11.6528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5575 -10.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4323 -10.6475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4531 -8.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5642 -9.1154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3277 -9.1361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3112 -10.1494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2701 -10.4784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8792 -9.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2969 -8.8387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0634 -12.1525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6753 -9.6225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3216 -8.1205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2975 -7.8256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1735 -7.3198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4214 -7.3198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0493 -7.8255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9255 -7.3198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3762 -10.8851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4225 -9.6327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5488 -10.9398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6452 -12.2768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9788 -8.6358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5672 -11.4459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6719 -7.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7949 -8.8345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5473 -7.8246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7474 -7.4424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4238 -8.2882 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.0692 -9.0828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1045 -8.6729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1430 -12.3679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8866 -9.7563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26 1 1 0 0 0 2 5 1 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 3 19 1 6 0 0 4 7 1 0 0 0 6 5 1 0 0 0 6 7 1 0 0 0 6 20 1 1 0 0 6 10 1 0 0 0 7 8 1 0 0 0 7 30 1 6 0 0 8 9 1 0 0 0 9 11 1 0 0 0 10 11 1 0 0 0 10 13 1 0 0 0 10 29 1 6 0 0 11 28 1 1 0 0 11 15 1 0 0 0 14 12 1 0 0 0 12 13 1 0 0 0 18 14 1 0 0 0 14 21 1 1 0 0 14 15 1 0 0 0 15 16 1 0 0 0 15 27 1 6 0 0 16 17 1 0 0 0 17 18 1 0 0 0 18 22 1 0 0 0 18 31 1 6 0 0 22 23 1 0 0 0 22 24 1 6 0 0 23 25 1 0 0 0 25 26 1 0 0 0 16 32 1 1 0 0 1 33 1 0 0 0 1 34 1 0 0 0 33 35 1 0 0 0 37 36 2 0 0 0 38 37 2 0 0 0 37 39 1 0 0 0 35 37 1 0 0 0 9 40 1 6 0 0 17 41 1 6 0 0 M END > LMST05020065 > Sycosterol A > 3alpha,7alpha,8beta,15beta,16alpha-pentahydroxy-5alpha-cholestane-26-sulfate > C27H48O9S > 548.30 > Sterol Lipids [ST] > Steroid conjugates [ST05] > Sulfates [ST0502] > - > > WGOMYZSXZKFCQS-SKIKMFFJSA-N > InChI=1S/C27H48O9S/c1-15(14-36-37(33,34)35)6-5-7-16(2)21-22(30)23(31)24-26(21,4)11-9-19-25(3)10-8-18(28)12-17(25)13-20(29)27(19,24)32/h15-24,28-32H,5-14H2,1-4H3,(H,33,34,35)/t15?,16-,17-,18-,19-,20-,21+,22+,23-,24-,25+,26-,27-/m1/s1 > C(C)(COS(O)(=O)=O)CCC[C@@H](C)[C@@]1([H])[C@H](O)[C@@H](O)[C@]2([H])[C@]1(C)CC[C@@]1([H])[C@@]2(O)[C@H](O)C[C@]2([H])[C@]1(C)CC[C@@H](O)C2 > - > - > - > ST 27:0;O6;S > - > - > 162679353 > - > Sterol Lipids [ST] > Bile acids and derivatives [ST04] > C27 bile acids, alcohols, and derivatives [ST0403] > - > 322838 > 34787419 $$$$