LMST01070034 LIPID_MAPS_STRUCTURE_DATABASE 69 77 0 0 0 999 V2000 1.2140 6.1798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1998 4.4514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8043 4.4657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7896 6.2056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2831 7.0582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7621 7.7615 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2143 6.1855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2928 5.3214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2973 5.3299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7898 6.1998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2828 7.0639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7754 7.9338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4037 8.5286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3887 8.3566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0601 9.4678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7819 1.8315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7612 2.0926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4795 1.3744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4589 1.6353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7238 2.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0056 3.3371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0221 3.0720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2184 0.3950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1772 0.9171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7032 2.8800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 4.4014 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2105 10.9502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5253 11.4160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6127 11.0538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4308 11.3636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9675 10.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8259 10.8168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6236 7.6593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6182 9.6815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7427 9.1711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7516 8.1605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5029 9.1811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4993 8.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2502 8.1634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2537 9.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3800 9.6869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6236 8.4722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5029 10.0302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4993 7.4092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8815 7.6593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8815 6.6534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7516 6.1523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6236 6.6534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0169 8.1585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1523 7.6593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1523 6.6612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0169 6.1621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8815 8.4290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7516 7.4880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3800 10.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0572 9.6389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0644 10.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8052 11.0840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8562 5.9175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2733 6.1535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2129 4.4157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7554 7.0443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2418 7.7573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2596 6.1595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7454 5.2834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 5.2919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2277 6.1740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7418 7.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2423 7.9321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6 12 1 0 0 0 11 5 1 0 0 0 5 7 1 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 9 10 1 0 0 0 10 11 1 0 0 0 11 12 1 1 0 0 7 1 1 1 0 0 8 2 1 6 0 0 9 3 1 1 0 0 10 4 1 6 0 0 6 13 1 0 0 0 13 14 2 0 0 0 13 15 1 0 0 0 21 26 1 1 0 0 18 23 1 1 0 0 19 24 1 6 0 0 20 25 1 6 0 0 17 16 1 6 0 0 18 17 1 0 0 0 19 18 1 0 0 0 20 19 1 0 0 0 21 20 1 0 0 0 22 21 1 0 0 0 17 22 1 0 0 0 65 26 1 6 0 0 30 27 1 1 0 0 28 57 1 0 0 0 29 28 1 0 0 0 30 29 1 0 0 0 31 30 1 0 0 0 32 31 1 0 0 0 57 32 1 1 0 0 33 36 1 0 0 0 0 33 38 1 0 0 0 0 37 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 37 38 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 37 1 0 0 0 0 38 39 1 0 0 0 0 33 42 1 1 0 0 0 37 43 1 1 0 0 0 38 44 1 6 0 0 0 36 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 33 1 0 0 0 0 45 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 46 1 0 0 0 0 45 53 1 1 0 0 0 36 54 1 6 0 0 0 41 55 1 1 0 0 0 40 56 1 1 0 0 0 55 57 1 0 0 0 0 57 56 1 0 0 0 0 55 58 1 6 0 0 0 46 59 1 1 0 0 51 60 1 1 0 0 63 69 1 0 0 0 68 62 1 0 0 0 62 64 1 0 0 0 64 65 1 0 0 0 65 66 1 0 0 0 66 67 1 0 0 0 67 68 1 0 0 0 68 69 1 1 0 0 64 60 1 1 0 0 66 61 1 1 0 0 67 1 1 6 0 0 M END > LMST01070034 > Shatavarin X > 3-O-{[alpha-l-rhamnopyranosyl(1-2)[6-O-acetyl-beta-d-glucopyranosyl(1-4)]]-beta-d-glucopyranosyl}-(25S)-5beta-spirostan-3beta-ol > C47H76O18 > 928.50 > Sterol Lipids [ST] > Sterols [ST01] > Furostanols and derivatives [ST0107] > - > > QPCXNOOIVSKVLM-KCROQFHVSA-N > InChI=1S/C47H76O18/c1-20-9-14-47(58-18-20)21(2)32-29(65-47)16-28-26-8-7-24-15-25(10-12-45(24,5)27(26)11-13-46(28,32)6)60-44-41(64-42-37(54)35(52)33(50)22(3)59-42)39(56)40(30(17-48)61-44)63-43-38(55)36(53)34(51)31(62-43)19-57-23(4)49/h20-22,24-44,48,50-56H,7-19H2,1-6H3/t20-,21-,22-,24+,25-,26+,27-,28-,29-,30+,31+,32-,33-,34+,35+,36-,37+,38+,39-,40+,41+,42-,43-,44+,45-,46-,47+/m0/s1 > O([C@@H]1[C@@H](CO)O[C@@H](O[C@@H]2C[C@@]3([H])CC[C@@]4([H])[C@]5([H])C[C@@H]6O[C@@]7([C@@H](C)[C@@H]6[C@@]5(C)CC[C@]4([H])[C@@]3(C)CC2)CC[C@@H](CO7)C)[C@@H]([C@H]1O)O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O)C)[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(C)=O)O1 > - > - > - > - > - > - > - > - > - > - > - > - > 272846 > 17936315 $$$$