LMPR0104200001 LIPID_MAPS_STRUCTURE_DATABASE 23 26 0 0 0 999 V2000 7.8396 8.6544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8396 7.6561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5455 6.9501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5438 6.9501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2497 7.6561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2497 8.6544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5438 9.3602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5455 9.3602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9501 7.2028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1062 6.2168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0923 6.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9970 6.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9830 6.2168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1391 7.2028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0287 7.6561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0607 7.6561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8659 7.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9258 10.2825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0221 6.0990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0809 8.6529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0024 8.1997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9797 9.2443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9556 8.3619 0.0000 H 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 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 1 1 0 0 0 0 2 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 3 1 0 0 0 0 4 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 5 1 0 0 0 0 14 15 1 6 0 0 0 9 16 1 1 0 0 0 15 17 1 0 0 0 0 7 18 1 0 0 0 0 4 19 1 6 0 0 0 15 20 1 0 0 0 0 2 21 1 6 0 0 0 9 21 1 6 0 0 0 1 22 2 0 0 0 0 5 23 1 6 0 0 0 M END > LMPR0104200001 > 7,8-Epoxybasm-4-en-6-one > > C20H30O2 > 302.22 > Prenol Lipids [PR] > Isoprenoids [PR01] > C20 isoprenoids (diterpenes) [PR0104] > Rearranged cembrane diterpenoids [PR010420] > > XSTDCUOYLNXBIN-PSBVTDFSSA-N > InChI=1S/C20H30O2/c1-12(2)14-6-8-18(4)15(14)10-13(3)11-17(21)20-16(18)7-9-19(20,5)22-20/h11-12,14-16H,6-10H2,1-5H3/b13-11-/t14-,15-,16?,18+,19-,20-/m0/s1 > C1(=O)C=C(C)C[C@@]2([H])[C@H](C(C)C)CC[C@@]2(C)C2CC[C@@]3(O[C@]123)C > - > - > - > - > - > - > 42608228 > - > - > - > - > - > 4097 > - $$$$