LMST01031253 LIPID_MAPS_STRUCTURE_DATABASE 41 44 0 0 0 999 V2000 8.2780 8.3416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3279 7.7932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3279 6.6961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2780 6.1474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2278 6.6961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1779 6.1474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1280 6.6961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1280 7.7932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1779 8.3416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2278 7.7932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1779 9.4386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1280 9.9870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0780 9.4386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0780 8.3416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9785 8.3416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9785 9.4386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0284 9.9870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0780 10.2888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2278 8.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0284 10.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1348 11.1040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7884 11.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5485 10.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3085 11.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0684 10.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8285 11.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0439 10.0744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6436 10.3424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0284 11.8006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6481 6.3037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3069 12.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1028 8.5490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1572 7.4188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0780 7.6924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2278 5.6864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2781 5.1378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6369 8.2182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4869 9.8636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7821 6.8038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 6.3039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7822 7.8038 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 3 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 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 20 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 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 25 27 1 0 0 0 0 1 10 1 0 0 0 0 5 10 1 0 0 0 0 9 10 1 0 0 0 0 8 14 1 0 0 0 0 13 17 1 0 0 0 0 13 18 1 1 0 0 0 10 19 1 1 0 0 0 20 21 1 6 0 0 0 17 28 1 6 0 0 0 20 29 1 1 0 0 0 3 30 1 1 0 0 0 24 31 2 0 0 0 0 8 32 1 1 0 0 0 9 33 1 6 0 0 0 14 34 1 6 0 0 0 5 35 1 6 0 0 4 36 1 6 0 0 2 37 1 1 0 0 11 38 1 1 0 0 30 39 1 0 0 0 39 40 2 0 0 0 39 41 1 0 0 0 M END > LMST01031253 > 3-O-acetylhyrtiosterol > 3beta-acetoxy-4alpha-methyl-5alpha-cholest-22E,24(28)-dien-2beta,8beta,11beta-triol > C31H50O5 > 502.37 > Sterol Lipids [ST] > Sterols [ST01] > Ergosterols and C24-methyl derivatives [ST0103] > - > > XJTNAVBFPRMDCX-SLMMZEKESA-N > InChI=1S/C31H50O5/c1-17(2)18(3)9-10-19(4)22-11-12-26-29(22,7)16-25(34)28-30(8)15-24(33)27(36-21(6)32)20(5)23(30)13-14-31(26,28)35/h9-10,17,19-20,22-28,33-35H,3,11-16H2,1-2,4-8H3/b10-9+/t19-,20+,22-,23+,24+,25+,26-,27-,28-,29-,30+,31-/m1/s1 > C1[C@]2(C)[C@@]3([H])[C@@H](O)C[C@]4(C)[C@@]([H])([C@]([H])(C)/C=C/C(=C)C(C)C)CC[C@@]4([H])[C@]3(O)CC[C@@]2([H])[C@H](C)[C@@H](OC(C)=O)[C@H]1O > - > - > - > ST 31:3;O5 > - > - > 163115327 > - > - > - > - > - > 151771 > 35031429 $$$$