LMST01060002 LIPID_MAPS_STRUCTURE_DATABASE 35 39 0 0 0 999 V2000 6.7458 6.5574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5946 7.0475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5946 8.0276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4404 6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4404 8.5227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2862 8.0276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2875 7.0475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1321 6.5613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9811 7.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1297 8.5215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9793 8.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9887 9.9896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1306 9.5031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8384 9.4925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8262 8.5076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5280 8.4868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5401 9.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6925 9.9772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8314 10.4729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6828 10.9578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8314 11.4479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5294 11.4529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2221 11.4577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0685 10.9679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0635 9.9877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9686 11.4874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2774 9.0126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3707 9.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3757 11.9478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3707 10.9679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2172 12.4378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2825 6.0725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0559 7.5347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8749 7.5709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9793 9.0263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14 12 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 2 4 1 0 0 0 0 4 7 1 0 0 0 0 6 5 1 0 0 0 0 6 7 1 0 0 0 0 14 18 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 6 27 1 1 0 0 0 14 19 1 1 0 0 0 15 16 1 0 0 0 0 2 1 1 1 0 0 0 18 20 1 1 0 0 0 3 2 1 0 0 0 0 20 21 1 0 0 0 0 6 10 1 0 0 0 0 20 22 1 0 0 0 0 22 30 1 0 0 0 0 7 8 1 0 0 0 0 30 23 1 0 0 0 0 8 9 1 0 0 0 0 23 24 1 0 0 0 0 9 11 1 0 0 0 0 24 25 1 0 0 0 0 10 11 1 0 0 0 0 24 26 1 0 0 0 0 30 28 1 1 0 0 0 22 29 1 1 0 0 0 3 5 1 0 0 0 0 29 30 1 0 0 0 0 10 13 1 0 0 0 0 23 31 1 6 0 0 0 11 15 1 0 0 0 0 7 32 1 6 0 0 0 10 33 1 6 0 0 15 34 1 6 0 0 11 35 1 1 0 0 M END > LMST01060002 > > gorgostan-3beta-ol > C30H52O > 428.40 > Sterol Lipids [ST] > Sterols [ST01] > Gorgosterols and derivatives [ST0106] > - > > HSYBQACFKPFBJN-SMBVQPOTSA-N > InChI=1S/C30H52O/c1-18(2)20(4)30(7)17-27(30)19(3)24-10-11-25-23-9-8-21-16-22(31)12-14-28(21,5)26(23)13-15-29(24,25)6/h18-27,31H,8-17H2,1-7H3/t19?,20-,21+,22+,23+,24-,25+,26+,27-,28+,29-,30-/m1/s1 > O[C@H]1CC[C@@]2([C@@]3([H])CC[C@]4(C)[C@@H](C([C@H]5C[C@]5(C)[C@H](C)C(C)C)C)CC[C@@]4([H])[C@]3([H])CC[C@@]2([H])C1)C > - > - > - > ST 30:1;O > - > - > 42608417 > - > - > - > - > - > 133434 > - $$$$