LMST05010042 LIPID_MAPS_STRUCTURE_DATABASE 49 53 0 0 0 999 V2000 10.5042 9.2897 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6552 8.7999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8015 9.2897 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6552 7.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9569 8.7999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8015 7.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5042 7.3355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9569 7.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2201 9.4425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8015 6.3606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1212 7.3355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4088 10.3993 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2946 9.1234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7871 10.7896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7816 12.7916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9150 12.2862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9238 11.2857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6575 12.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6540 11.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3872 11.2886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3908 12.2901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5259 12.7969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7843 11.7716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6259 13.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5151 13.7705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3775 14.2599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5273 14.7524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2221 13.7684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0704 14.2540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9150 13.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6529 10.3217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0623 10.7896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0623 9.7940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9238 9.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7871 9.7940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2065 11.2838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3507 10.7896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3507 9.8015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2065 9.3074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0623 11.7779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3799 13.1750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7523 14.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9238 10.2976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0623 8.8056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6425 9.2989 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7816 13.7799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7724 14.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9116 12.7742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7709 13.2683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 6 0 0 0 5 8 1 0 0 0 0 5 9 1 1 0 0 0 6 10 1 1 0 0 0 8 11 1 6 0 0 0 9 12 1 0 0 0 0 9 13 2 0 0 0 0 6 8 1 0 0 0 0 14 17 1 0 0 0 0 14 19 1 0 0 0 0 18 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 18 1 0 0 0 0 19 20 1 0 0 0 0 14 23 1 1 0 0 0 18 24 1 1 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 1 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 19 31 1 6 0 0 0 17 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 14 1 0 0 0 0 32 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 33 1 0 0 0 0 32 40 1 1 0 0 0 22 41 1 6 0 0 0 25 42 1 6 0 0 0 17 43 1 6 0 0 0 33 44 1 1 0 0 0 38 1 1 6 0 0 0 35 45 1 6 0 0 0 15 46 1 6 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 M END > LMST05010042 > > Cholestane-3,7,12,25-tetrol-3-glucuronide > C33H56O10 > 612.39 > Sterol Lipids [ST] > Steroid conjugates [ST05] > Glucuronides [ST0501] > - > > FHOADKVSESICIH-MXSWZLSHSA-N > InChI=1S/C33H56O10/c1-16(7-6-11-31(2,3)41)19-8-9-20-24-21(15-23(35)33(19,20)5)32(4)12-10-18(13-17(32)14-22(24)34)42-30-27(38)25(36)26(37)28(43-30)29(39)40/h16-28,30,34-38,41H,6-15H2,1-5H3,(H,39,40)/t16-,17+,18-,19-,20+,21+,22-,23+,24+,25+,26+,27-,28+,30-,32+,33-/m1/s1 > O([C@H]1C[C@@]2([H])C[C@@H](O)[C@@]3([H])[C@]4([H])CC[C@]([H])([C@@](C)([H])CCCC(O)(C)C)[C@@]4(C)[C@@H](O)C[C@]3([H])[C@@]2(C)CC1)[C@H]1[C@H](O)[C@H]([C@H](O)[C@@H](C(=O)O)O1)O > - > HMDB10355 > - > ST 27:0;O4;GlcA > - > - > 44263366 > - > Sterol Lipids [ST] > Bile acids and derivatives [ST04] > C27 bile acids, alcohols, and derivatives [ST0403] > - > - > - $$$$