LMPR0104230014 LIPID_MAPS_STRUCTURE_DATABASE 44 47 0 0 0 999 V2000 12.2836 10.4478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2836 9.4348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1605 8.9282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1605 10.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6826 8.3669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7066 8.6387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6288 8.7254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1807 9.5743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1400 10.5863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5182 11.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5426 11.6586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5975 11.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0381 10.4478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0381 9.4348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1605 7.9153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0911 12.1701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0381 11.4608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9621 8.7767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7309 7.3561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7074 7.0898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2620 7.9361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0662 6.1425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9410 6.7220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0916 10.9338 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4062 8.9282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2000 7.7614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4203 9.3455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4437 8.2115 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1603 11.9679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4057 10.9547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5281 10.4473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6499 10.9537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5286 9.4336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7715 6.8428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7617 6.7543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3529 6.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2642 11.9188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4975 12.5607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2207 12.3099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0470 13.2947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4546 11.6671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9062 8.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9062 8.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4062 7.1961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 14 1 0 0 0 0 13 4 1 0 0 0 0 4 1 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 6 14 1 0 0 0 0 3 15 1 1 0 0 0 12 16 1 6 0 0 0 13 17 1 1 0 0 0 14 18 1 6 0 0 0 5 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 7 21 1 6 0 0 0 20 22 2 0 0 0 0 19 23 1 6 0 0 0 9 24 1 0 0 0 0 2 25 1 6 0 0 0 6 26 1 6 0 0 0 5 27 1 6 0 0 0 3 28 1 6 0 0 4 29 1 6 0 0 28 15 1 0 0 0 1 30 1 6 0 0 30 31 1 0 0 0 31 32 1 0 0 0 31 33 2 0 0 0 26 34 1 0 0 0 34 35 2 0 0 0 34 36 1 0 0 0 24 37 1 0 0 0 37 38 2 0 0 0 29 39 1 0 0 0 39 40 2 0 0 0 39 41 1 0 0 0 25 42 1 0 0 0 42 43 1 0 0 0 42 44 2 0 0 0 M END > LMPR0104230014 > Gemmacolide F > > C28H34O15 > 610.19 > Prenol Lipids [PR] > Isoprenoids [PR01] > C20 isoprenoids (diterpenes) [PR0104] > Briarane diterpenoids [PR010423] > > IYYJBLOPEZPOGS-OZMSVQNESA-N > InChI=1S/C28H34O15/c1-12-25(35)43-19-9-17(37-11-29)7-8-18(34)26(6)21(24(28(12,19)36)42-16(5)33)27(10-38-27)23(41-15(4)32)20(39-13(2)30)22(26)40-14(3)31/h7-9,11-12,18-24,34,36H,10H2,1-6H3/b8-7-,17-9+/t12-,18+,19-,20+,21+,22-,23+,24+,26+,27-,28-/m0/s1 > [C@@H]1(OC(=O)C)[C@H](OC(C)=O)[C@@]2(C)[C@@]([H])([C@@H](OC(C)=O)[C@]3(O)[C@@H](C)C(=O)O[C@H]3C=C(OC=O)C=C[C@H]2O)[C@]2(OC2)[C@@H]1OC(=O)C > - > - > - > - > - > - > - > - > - > - > - > - > 86560 > - $$$$