LMST01060030 LIPID_MAPS_STRUCTURE_DATABASE 44 48 0 0 0 999 V2000 8.3427 8.4070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3852 7.8541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3852 6.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3427 6.1956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3001 6.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2574 6.1956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2151 6.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2151 7.8541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2574 8.4070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3001 7.8541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2574 9.5124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2151 10.0652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1726 9.5124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1726 8.4070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0875 8.4070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0875 9.5124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1301 10.0652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1726 10.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3001 8.6282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1301 10.9497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2296 11.1909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8960 11.3919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6620 10.9497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4280 11.3919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1939 10.9497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9600 11.3919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1939 10.2030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7502 10.4233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1301 11.8928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7001 6.3531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4264 12.2265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2151 8.7940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2367 7.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1726 7.5490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6620 10.1734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5876 11.8148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2152 11.0604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3958 10.0099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3001 5.7476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2573 5.1948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3486 11.5608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3487 12.5615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4819 11.0606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3427 9.4070 0.0000 O 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 1 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 1 6 0 0 0 8 32 1 1 0 0 0 9 33 1 6 0 0 0 14 34 1 6 0 0 0 23 35 1 0 0 0 0 22 36 1 1 0 0 0 23 36 1 1 0 0 0 12 37 1 1 0 0 11 38 1 6 0 0 5 39 1 6 0 0 6 40 1 1 0 0 37 41 1 0 0 0 41 42 1 0 0 0 41 43 2 0 0 0 1 44 1 6 0 0 M END > LMST01060030 > > Gorgostane-1alpha,3beta,5alpha,6beta,11alpha,12beta-hexol 12-acetate > C32H54O7 > 550.39 > Sterol Lipids [ST] > Sterols [ST01] > Gorgosterols and derivatives [ST0106] > - > Gorgostane-12beta-acetoxy-1alpha,3beta,5alpha,6beta,11alpha-pentol > YVIIYLNDSBRNFS-ZXYBZZKYSA-N > InChI=1S/C32H54O7/c1-15(2)17(4)29(6)14-23(29)16(3)21-9-10-22-20-12-25(36)32(38)13-19(34)11-24(35)31(32,8)26(20)27(37)28(30(21,22)7)39-18(5)33/h15-17,19-28,34-38H,9-14H2,1-8H3/t16-,17+,19-,20-,21+,22-,23+,24-,25+,26+,27-,28+,29+,30+,31+,32-/m0/s1 > [C@@H]1(O)[C@]2(C)[C@@]3([H])[C@H](O)[C@@H](OC(=O)C)[C@]4(C)[C@@]([H])([C@]([H])(C)[C@H]5C[C@]5(C)[C@H](C)C(C)C)CC[C@@]4([H])[C@]3([H])C[C@@H](O)[C@@]2(O)C[C@@H](O)C1 > - > - > - > ST 32:2;O7 > - > - > 11028032 > - > - > - > - > - > 1074818 > 5432671 $$$$