LMST05020059 LIPID_MAPS_STRUCTURE_DATABASE 41 44 0 0 0 999 V2000 9.1827 10.2179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2953 9.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2953 8.6999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1827 8.1937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0421 8.6999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9201 8.1937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0421 9.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9201 11.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8178 11.7261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6771 11.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6771 10.2179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6409 9.9024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2136 10.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6409 11.5252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6771 12.2511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0421 10.7236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6771 9.3989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2503 11.9206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9201 10.2179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9201 9.2041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7635 13.0727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8178 9.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8178 10.5413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8178 8.6999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3961 12.5660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2735 13.0727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1511 12.5660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1511 11.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5186 13.0727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6409 12.5660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0286 13.0727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3947 8.1708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0468 7.6863 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2735 14.0865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2735 15.1003 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.2729 15.0399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3812 15.2112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2735 16.1141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2274 10.6991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9571 8.9392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9153 7.1801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11 10 1 0 0 0 0 14 10 1 0 0 0 0 9 10 1 0 0 0 0 10 15 1 1 0 0 0 22 11 1 0 0 0 0 12 11 1 0 0 0 0 11 17 1 6 0 0 0 8 19 1 0 0 0 0 7 19 1 0 0 0 0 22 19 1 0 0 0 0 24 22 1 0 0 0 0 5 7 1 0 0 0 0 7 16 1 1 0 0 0 1 7 1 0 0 0 0 13 14 1 0 0 0 0 30 14 1 0 0 0 0 14 18 1 6 0 0 0 8 9 1 0 0 0 0 13 12 1 0 0 0 0 6 24 1 0 0 0 0 4 5 1 0 0 0 0 6 5 1 0 0 0 0 2 1 1 0 0 0 0 3 4 1 0 0 0 0 3 2 1 0 0 0 0 3 32 1 1 0 0 0 19 20 1 6 0 0 0 30 21 1 6 0 0 0 22 23 1 1 0 0 0 29 25 1 0 0 0 0 26 25 1 0 0 0 0 27 26 1 0 0 0 0 28 27 1 0 0 0 0 31 27 1 0 0 0 0 29 30 1 0 0 0 0 5 33 1 6 0 0 26 34 1 6 0 0 34 35 1 0 0 0 35 36 2 0 0 0 35 37 2 0 0 0 35 38 1 0 0 0 13 39 1 1 0 0 12 40 1 6 0 0 6 41 1 1 0 0 M END > LMST05020059 > Microdiscusol G > 24S-methyl-3beta,5alpha,6beta,15alpha,16beta-pentahydroxy-colestane 28-sulfate > C27H48O9S > 548.30 > Sterol Lipids [ST] > Steroid conjugates [ST05] > Sulfates [ST0502] > - > 24S-methyl-5alpha-cholestane-3beta,5,6beta,15alpha,16beta-pentaol-28-yl sulfate > XGCDWALUXRJYCP-JJFZKVPHSA-N > InChI=1S/C27H48O9S/c1-14(2)19(36-37(33,34)35)7-6-15(3)21-23(30)24(31)22-17-12-20(29)27(32)13-16(28)8-11-26(27,5)18(17)9-10-25(21,22)4/h14-24,28-32H,6-13H2,1-5H3,(H,33,34,35)/t15-,16+,17-,18+,19+,20-,21+,22-,23-,24-,25-,26-,27+/m1/s1 > C1C[C@H](O)C[C@]2(O)[C@H](O)C[C@]3([H])[C@@]([H])([C@]21C)CC[C@]1(C)[C@@]([H])([C@@H](CC[C@H](OS(O)(=O)=O)C(C)C)C)[C@@H](O)[C@H](O)[C@]13[H] > - > - > - > ST 27:0;O6;S > - > - > 171120570 > - > Sterol Lipids [ST] > Sterols [ST01] > Ergosterols and C24-methyl derivatives [ST0103] > - > 7601 > 33084411 $$$$