LMPR0102070046 LIPID_MAPS_STRUCTURE_DATABASE 40 43 0 0 0 999 V2000 14.5074 -3.2824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3754 -3.7835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3754 -4.7857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5074 -5.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6394 -4.7857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6394 -3.7835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6862 -5.0955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0972 -4.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6862 -3.4737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6394 -2.7813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6394 -5.7038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3765 -6.0487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3963 -6.2571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0473 -6.7935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5074 -6.2891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2373 -7.3041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2232 -9.3104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4815 -10.2967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6279 -7.7879 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9241 -10.2693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5015 -7.2898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3667 -7.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3580 -8.8030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4873 -9.2961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6223 -8.7885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7516 -9.2816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1553 -10.9123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3277 -11.8996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2141 -10.5680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5054 -11.2767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5373 -11.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2778 -10.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9865 -9.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9547 -9.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5074 -2.2821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3737 -1.7820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6412 -1.7820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3117 -9.7904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7276 -8.3744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7615 -8.1155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 6 1 1 0 0 0 5 7 1 0 0 0 7 8 2 0 0 0 8 9 1 0 0 0 9 6 1 0 0 0 6 10 1 1 0 0 5 11 1 1 0 0 7 12 1 0 0 0 12 13 2 0 0 0 12 14 1 0 0 0 4 15 1 1 0 0 20 26 1 0 0 0 25 19 1 0 0 0 19 21 1 0 0 0 21 22 1 0 0 0 22 23 1 0 0 0 23 24 1 0 0 0 24 25 1 0 0 0 25 26 1 1 0 0 21 15 1 1 0 0 22 16 1 6 0 0 23 17 1 1 0 0 24 18 1 1 0 0 20 27 1 0 0 0 27 28 2 0 0 0 27 29 1 0 0 0 29 30 1 0 0 0 30 31 2 0 0 0 31 32 1 0 0 0 32 33 2 0 0 0 33 34 1 0 0 0 34 29 2 0 0 0 1 35 1 0 0 0 35 36 1 0 0 0 35 37 2 0 0 0 32 38 1 0 0 0 33 39 1 0 0 0 39 40 1 0 0 0 M END > LMPR0102070046 > Tarenninoside C > > C24H26O15 > 554.13 > Prenol Lipids [PR] > Isoprenoids [PR01] > C10 isoprenoids (monoterpenes) [PR0102] > Iridoid, 10-alkyliridoid and secoiridoid monoterpenoids [PR010207] > 6'-O-vanilloylixoside > XSOZSPPTGNWATK-CVYFQNDBSA-N > InChI=1S/C24H26O15/c1-35-14-6-9(2-5-13(14)25)21(33)36-8-15-16(26)17(27)18(28)22(38-15)39-23-24(34)11(3-4-12(24)20(31)32)10(7-37-23)19(29)30/h2,4-7,11,15-18,22-23,25-28,34H,3,8H2,1H3,(H,29,30)(H,31,32)/t11-,15-,16+,17+,18-,22+,23+,24-/m1/s1 > C1(C(=O)O)[C@@]2([H])CC=C(C(O)=O)[C@@]2(O)[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O)[C@@H](COC(C3=CC(OC)=C(O)C=C3)=O)O2)OC=1 > - > - > - > - > - > - > 171121218 > - > - > - > - > - > 1547788 > 16792422 $$$$