LMST01120029 LIPID_MAPS_STRUCTURE_DATABASE 41 46 0 0 0 999 V2000 14.5158 -9.7022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3842 -10.2036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3842 -11.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5158 -11.7080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6473 -11.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6473 -10.2036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2527 -9.7022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1212 -10.2035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1212 -11.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2527 -11.7080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2526 -8.6994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1211 -8.1979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9897 -8.6994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9897 -9.7021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8580 -8.1978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7266 -8.6993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7267 -9.7020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8580 -7.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7789 -11.7080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9897 -10.7050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3606 -9.2161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9774 -7.7003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3720 -11.9046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2541 -10.4392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0469 -6.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3567 -5.6518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.3594 -5.6518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6693 -6.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9489 -4.8405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0908 -13.5575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1448 -13.8863 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8917 -12.3675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1767 -11.1119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8082 -11.8733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4643 -12.7980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4886 -12.9616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -12.2021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2062 -11.2775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5797 -10.5180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1726 -14.0508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1212 -9.2175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 7 1 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 9 10 1 0 0 0 10 3 1 0 0 0 7 11 1 0 0 0 11 12 1 0 0 0 12 13 1 0 0 0 13 14 1 0 0 0 14 8 1 0 0 0 13 15 1 0 0 0 15 16 1 0 0 0 16 17 1 0 0 0 15 18 1 1 0 0 5 19 1 1 0 0 14 20 1 1 0 0 2 21 1 1 0 0 13 22 1 1 0 0 3 23 1 1 0 0 7 24 1 6 0 0 18 25 1 0 0 0 25 26 1 0 0 0 26 27 1 0 0 0 27 28 1 0 0 0 28 18 2 0 0 0 27 29 2 0 0 0 14 17 1 0 0 0 38 33 1 0 0 0 33 34 1 0 0 0 34 35 1 0 0 0 35 36 1 0 0 0 36 37 1 0 0 0 37 38 1 0 0 0 38 39 1 1 0 0 34 19 1 1 0 0 35 30 1 6 0 0 36 31 1 1 0 0 37 32 1 1 0 0 31 40 1 0 0 0 8 41 1 1 0 0 M END > LMST01120029 > Odoroside H > 3beta-O-(d-digitalosyl)-14beta-hydroxy-5beta-card-20(22)-enolide > C30H46O8 > 534.32 > Sterol Lipids [ST] > Sterols [ST01] > Cardanolides and derivatives [ST0112] > - > > VPUNMTHWNSJUOG-HYDVPRFCSA-N > InChI=1S/C30H46O8/c1-16-24(32)26(35-4)25(33)27(37-16)38-19-7-10-28(2)18(14-19)5-6-22-21(28)8-11-29(3)20(9-12-30(22,29)34)17-13-23(31)36-15-17/h13,16,18-22,24-27,32-34H,5-12,14-15H2,1-4H3/t16-,18-,19+,20-,21+,22-,24+,25-,26+,27+,28+,29-,30+/m1/s1 > C1C[C@H](O[C@H]2[C@H](O)[C@@H](OC)[C@@H](O)[C@@H](C)O2)C[C@@]2([H])CC[C@@]3([H])[C@]4(CC[C@H](C5=CC(=O)OC5)[C@@]4(C)CC[C@]3([H])[C@@]12C)O > - > - > - > - > - > - > 205840 > - > - > - > - > - > 63479 > 9214727 $$$$