LMPR02030027 LIPID_MAPS_STRUCTURE_DATABASE 52 53 0 0 0 0 0 0 0 0999 V2000 7.2222 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2222 6.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6666 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6666 5.8339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6666 7.7584 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6666 5.1924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1111 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6667 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2222 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7778 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2222 7.7584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5556 5.8339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1112 6.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5556 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1112 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 6.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3334 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8889 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.4444 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0000 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.4444 7.7584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8889 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4445 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0000 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5556 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0000 7.7584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6667 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2223 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7778 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3333 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7778 7.7584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4445 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0000 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5555 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1111 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5555 7.7584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2222 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7778 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3333 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8889 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3333 7.7584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0000 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5556 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1111 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6667 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1111 7.7584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7778 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3334 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8889 7.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4444 6.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8889 7.7584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 1 1 0 0 0 0 4 2 1 0 0 0 0 16 3 1 0 0 0 0 13 4 1 0 0 0 0 5 3 2 0 0 0 0 6 4 2 0 0 0 0 8 7 1 0 0 0 0 9 8 2 0 0 0 0 10 9 1 0 0 0 0 11 9 1 0 0 0 0 17 12 2 0 0 0 0 12 13 1 0 0 0 0 14 15 2 0 0 0 0 15 17 1 0 0 0 0 14 16 1 0 0 0 0 13 16 2 0 0 0 0 19 18 1 0 0 0 0 20 19 2 0 0 0 0 21 20 1 0 0 0 0 22 20 1 0 0 0 0 24 23 1 0 0 0 0 25 24 2 0 0 0 0 26 25 1 0 0 0 0 27 25 1 0 0 0 0 29 28 1 0 0 0 0 30 29 2 0 0 0 0 31 30 1 0 0 0 0 32 30 1 0 0 0 0 34 33 1 0 0 0 0 35 34 2 0 0 0 0 36 35 1 0 0 0 0 37 35 1 0 0 0 0 39 38 1 0 0 0 0 40 39 2 0 0 0 0 41 40 1 0 0 0 0 42 40 1 0 0 0 0 44 43 1 0 0 0 0 45 44 2 0 0 0 0 46 45 1 0 0 0 0 47 45 1 0 0 0 0 49 48 1 0 0 0 0 50 49 2 0 0 0 0 51 50 1 0 0 0 0 52 50 1 0 0 0 0 18 10 1 0 0 0 0 7 26 1 0 0 0 0 23 31 1 0 0 0 0 28 36 1 0 0 0 0 33 41 1 0 0 0 0 38 46 1 0 0 0 0 43 51 1 0 0 0 0 1 48 1 0 0 0 0 M END > LMPR02030027 > 2-demethylmenaquinone-8 > 2-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl]naphthalene-1,4-dione > C50H70O2 > 702.54 > Prenol Lipids [PR] > Quinones and hydroquinones [PR02] > Vitamin K [PR0203] > - > (all-E)-2-(3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaenyl)-1,4-naphthalenedione; demethylmenaquinone > GDUBPWSFXUAETN-AENDIINCSA-N > InChI=1S/C50H70O2/c1-38(2)19-12-20-39(3)21-13-22-40(4)23-14-24-41(5)25-15-26-42(6)27-16-28-43(7)29-17-30-44(8)31-18-32-45(9)35-36-46-37-49(51)47-33-10-11-34-48(47)50(46)52/h10-11,19,21,23,25,27,29,31,33-35,37H,12-18,20,22,24,26,28,30,32,36H2,1-9H3/b39-21+,40-23+,41-25+,42-27+,43-29+,44-31+,45-35+ > C1(C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C)C(=O)C2=C(C=CC=C2)C(=O)C=1 > - > - > 48455 > - > - > - > 5376004 > - > - > - > - > - > - > - $$$$