LMST01160039 LIPID_MAPS_STRUCTURE_DATABASE 43 49 0 0 0 999 V2000 9.5683 7.5684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5628 9.6273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6714 9.1074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6805 8.0786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4636 9.1177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4600 8.0879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2426 8.0817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2463 9.1114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3567 9.6328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5683 8.4251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4636 10.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3456 10.6342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2325 11.1376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3456 11.4115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4600 7.3181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7946 7.5684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7946 6.5443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6805 6.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5683 6.5443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9142 8.0765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 7.5684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 6.5520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9142 6.0437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7946 8.3843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5608 11.1274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6805 7.2810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1644 10.5846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1093 11.1376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1093 12.2209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1644 12.7739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2325 12.2209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7907 10.7116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8925 12.6683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9142 9.0721 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9443 7.3753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6832 6.4146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3847 5.7080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7206 6.1602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8784 6.7032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8941 7.5698 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6800 5.0337 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1614 13.7743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2530 10.1425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 6 1 0 0 0 0 5 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 5 6 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 5 1 0 0 0 0 6 7 1 0 0 0 0 1 10 1 1 0 0 0 5 11 1 1 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 1 0 0 0 6 15 1 1 0 0 0 4 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 1 1 0 0 0 0 16 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 17 1 0 0 0 0 16 24 1 1 0 0 0 12 25 1 6 0 0 0 4 26 1 6 0 0 0 13 27 1 1 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 13 1 0 0 0 0 28 32 2 0 0 0 0 29 33 1 0 0 0 0 20 34 2 0 0 0 7 35 1 6 0 0 35 36 1 0 0 0 36 37 1 0 0 0 36 38 2 0 0 0 17 39 1 6 0 0 21 40 1 6 0 0 40 39 1 0 0 0 18 41 1 1 0 0 30 42 1 0 0 0 8 43 1 1 0 0 9 43 1 1 0 0 M END > LMST01160039 > Nicansteroidin D > 15alpha-acetoxy-16beta,17beta-epoxy-6beta,14beta-dihydroxy-1-oxo-2alpha,5alpha-dioxy-witha3,24-dien-26,22-olide > C30H38O10 > 558.25 > Sterol Lipids [ST] > Sterols [ST01] > Withanolides and derivatives [ST0116] > - > > UMKFPSOCMNHMRG-JLMBNDLYSA-N > InChI=1S/C30H38O10/c1-13-11-20(37-25(34)14(13)2)15(3)30-24(38-30)23(36-16(4)31)29(35)18-12-21(32)28-10-8-19(39-40-28)22(33)27(28,6)17(18)7-9-26(29,30)5/h8,10,15,17-21,23-24,32,35H,7,9,11-12H2,1-6H3/t15-,17+,18-,19+,20-,21-,23+,24+,26+,27+,28+,29-,30+/m1/s1 > [C@]12(C[C@@H](O)[C@@]34OO[C@@H](C=C3)C(=O)[C@]4(C)[C@@]1([H])CC[C@]1(C)[C@]3(O[C@H]3[C@H](OC(=O)C)[C@]21O)[C@@](C)([H])[C@H]1CC(C)=C(C)C(=O)O1)[H] > - > - > - > ST 30:8;O10 > - > - > 164614692 > - > - > - > - > - > 304159 > 34549952 $$$$