LMST01070033 LIPID_MAPS_STRUCTURE_DATABASE 66 74 0 0 0 999 V2000 2.2395 7.9223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7384 7.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2249 6.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7236 5.2853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7408 5.2769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2543 6.1519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2403 7.7477 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7507 7.0356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2125 6.1721 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2102 4.4102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2668 6.1459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8465 5.9102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7918 11.0703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0482 10.4964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0410 9.6270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3659 10.4964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7408 7.4787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8717 8.4186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0082 6.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1447 6.6529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1447 7.6498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0082 8.1484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6117 6.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7408 6.1447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8717 6.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8717 7.6498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4863 7.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4899 10.0178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6117 8.4617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3659 9.6749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2385 9.1636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2350 8.1533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4863 8.1596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4899 9.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7408 8.1504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7319 9.1597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6063 9.6695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6117 7.6498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8088 10.8034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9489 10.4464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4117 11.3495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5946 11.0401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5085 11.4018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1904 10.9366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2397 4.3959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6961 2.8764 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 0.9160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2144 0.3945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0184 3.0682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0006 3.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7179 2.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4534 1.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4752 1.3727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7578 2.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7797 1.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1996 4.4459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8021 4.4602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7861 6.1979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2827 7.0495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7587 7.7519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 6.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2924 5.3148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2957 5.3233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7876 6.1921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2812 7.0551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7732 7.9240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3 9 1 6 0 0 4 10 1 1 0 0 6 11 1 1 0 0 2 1 1 1 0 0 3 2 1 0 0 0 4 3 1 0 0 0 5 4 1 0 0 0 6 5 1 0 0 0 8 6 1 0 0 0 2 8 1 0 0 0 7 1 1 0 0 0 20 11 1 1 0 0 25 12 1 1 0 0 16 13 1 6 0 0 0 14 15 1 0 0 0 0 16 14 1 0 0 0 0 31 15 1 1 0 0 0 30 16 1 1 0 0 0 35 17 1 6 0 0 0 26 18 1 1 0 0 0 19 25 1 0 0 0 0 20 19 1 0 0 0 0 21 20 1 0 0 0 0 22 21 1 0 0 0 0 26 22 1 0 0 0 0 23 38 1 0 0 0 0 24 23 1 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 35 26 1 0 0 0 0 33 27 1 6 0 0 0 34 28 1 1 0 0 0 38 29 1 1 0 0 0 33 32 1 0 0 0 0 30 34 1 0 0 0 0 31 30 1 0 0 0 0 32 31 1 0 0 0 0 34 33 1 0 0 0 0 36 35 1 0 0 0 0 37 36 1 0 0 0 0 34 37 1 0 0 0 0 38 33 1 0 0 0 0 38 35 1 0 0 0 0 14 39 1 1 0 0 39 40 1 0 0 0 40 41 1 0 0 0 41 42 1 0 0 0 42 43 1 0 0 0 43 14 1 0 0 0 41 44 1 1 0 0 5 45 1 6 0 0 54 49 1 0 0 0 49 50 1 0 0 0 50 51 1 0 0 0 51 52 1 0 0 0 52 53 1 0 0 0 53 54 1 0 0 0 54 55 1 6 0 0 51 46 1 6 0 0 52 47 1 6 0 0 53 48 1 1 0 0 50 45 1 1 0 0 60 66 1 0 0 0 65 59 1 0 0 0 59 61 1 0 0 0 61 62 1 0 0 0 62 63 1 0 0 0 63 64 1 0 0 0 64 65 1 0 0 0 65 66 1 1 0 0 61 9 1 1 0 0 62 56 1 6 0 0 63 57 1 1 0 0 64 58 1 6 0 0 M END > LMST01070033 > Shatavarin V > 3-O-{[alpha-l-rhamnopyranosyl(1-2)[beta-d-glucopyranosyl(1-4)]]-beta-d-glucopyranosyl}-(25S)-5beta-spirostan-3beta-ol > C45H74O17 > 886.49 > Sterol Lipids [ST] > Sterols [ST01] > Furostanols and derivatives [ST0107] > - > > MTIGBMJVOSJZQH-PJFZGHSASA-N > InChI=1S/C45H74O17/c1-19-8-13-45(55-18-19)20(2)30-27(62-45)15-26-24-7-6-22-14-23(9-11-43(22,4)25(24)10-12-44(26,30)5)57-42-39(61-40-35(52)33(50)31(48)21(3)56-40)37(54)38(29(17-47)59-42)60-41-36(53)34(51)32(49)28(16-46)58-41/h19-42,46-54H,6-18H2,1-5H3/t19-,20-,21-,22+,23-,24+,25-,26-,27-,28+,29+,30-,31-,32+,33+,34-,35+,36+,37-,38+,39+,40-,41-,42+,43-,44-,45+/m0/s1 > C(O)[C@H]1O[C@H]([C@H](O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)[C@H]([C@@H]1O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)O)O[C@H]1CC[C@@]2([C@@]3([C@@]([C@]4([C@](CC3)([C@@H]3[C@H](C4)O[C@@]4(OC[C@@H](C)CC4)[C@H]3C)C)[H])([H])CC[C@@]2(C1)[H])[H])C > - > - > - > - > - > - > 101422490 > - > - > - > - > - > 272846 > 17936315 $$$$