LMST01010362 LIPID_MAPS_STRUCTURE_DATABASE 41 44 0 0 0 0 0 0 0 0999 V2000 6.5059 6.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7392 6.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7392 5.3220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5059 4.8791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2723 5.3220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0388 4.8791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8056 5.3220 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8056 6.2071 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0388 6.6497 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2723 6.2071 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0388 7.5347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8056 7.9775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5722 7.5347 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5722 6.6497 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1054 6.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1054 7.5347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3387 7.9775 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5722 8.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2723 6.8268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3387 8.6856 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6179 8.8788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9519 9.0395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5652 8.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1786 9.0395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8351 8.2639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3387 9.4405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3804 4.9064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1908 5.0053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8056 6.9594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0223 5.9051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5722 5.9628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4050 9.0395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7915 8.0877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7915 8.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6465 8.4565 0.0000 D 0 0 0 0 0 0 0 0 0 0 0 0 13.8472 8.2729 0.0000 D 0 0 0 0 0 0 0 0 0 0 0 0 14.1715 9.4817 0.0000 D 0 0 0 0 0 0 0 0 0 0 0 0 12.9628 9.8060 0.0000 D 0 0 0 0 0 0 0 0 0 0 0 0 11.9066 8.0877 0.0000 D 0 0 0 0 0 0 0 0 0 0 0 0 12.7915 7.2027 0.0000 D 0 0 0 0 0 0 0 0 0 0 0 0 13.6766 8.0877 0.0000 D 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 2 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 34 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 25 1 6 0 0 0 20 26 1 1 0 0 0 7 27 1 6 0 0 0 3 28 2 0 0 0 0 8 29 1 1 0 0 0 9 30 1 6 0 0 0 14 31 1 6 0 0 0 34 35 1 0 0 0 0 34 32 1 0 0 0 0 34 33 1 0 0 0 0 32 36 1 0 0 0 0 32 37 1 0 0 0 0 32 38 1 0 0 0 0 33 39 1 0 0 0 0 33 40 1 0 0 0 0 33 41 1 0 0 0 0 M STY 2 1 SUP 2 SUP M SAL 1 4 32 36 37 38 M SBL 1 1 37 M SMT 1 CD3 M SAL 2 4 33 39 40 41 M SBL 2 1 38 M SMT 2 CD3 M END > LMST01010362 > > 7alpha-hydroxy-4-cholesten-3-one-d7 > C27H37D7O2 > 407.38 > Sterol Lipids [ST] > Sterols [ST01] > Cholesterol and derivatives [ST0101] > - > > IOIZWEJGGCZDOL-CTNVFXSSSA-N > InChI=1S/C27H44O2/c1-17(2)7-6-8-18(3)21-9-10-22-25-23(12-14-27(21,22)5)26(4)13-11-20(28)15-19(26)16-24(25)29/h15,17-18,21-25,29H,6-14,16H2,1-5H3/t18-,21-,22+,23+,24-,25+,26+,27-/m1/s1/i1D3,2D3,17D > C1[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@]([H])(C)CCCC(C([2H])([2H])[2H])(C([2H])([2H])[2H])[2H])CC[C@@]4([H])[C@]3([H])[C@H](O)CC2=CC(=O)C1 > - > - > - > - > 26100 > - > 46781728 > - > - > - > - > - > 32630 > - $$$$