Mrv1533005141516172D 49 49 0 0 0 0 999 V2000 -4.3301 0.9482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0445 1.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7591 0.9481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7591 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0446 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3301 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4736 -0.2892 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4736 -1.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0447 -1.1142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6156 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9011 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1867 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4722 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7577 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0433 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6711 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3856 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1001 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8145 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2435 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9579 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6724 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3869 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1013 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8158 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5303 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2448 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9592 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6737 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3882 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1026 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8171 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5316 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2461 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9605 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6750 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3895 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1039 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8184 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5329 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1867 -1.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6711 -1.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -1.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3869 -1.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2448 -1.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1026 -1.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9605 -1.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8184 -1.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 2 0 0 0 0 40 41 1 0 0 0 0 12 42 1 0 0 0 0 16 43 1 0 0 0 0 20 44 1 0 0 0 0 24 45 1 0 0 0 0 28 46 1 0 0 0 0 32 47 1 0 0 0 0 36 48 1 0 0 0 0 40 49 1 0 0 0 0 M END > M2MDB000621 > M2MDB > COC1=CC=CC(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)CCC=C(C)C)=C1O > InChI=1S/C47H72O2/c1-37(2)19-11-20-38(3)21-12-22-39(4)23-13-24-40(5)25-14-26-41(6)27-15-28-42(7)29-16-30-43(8)31-17-32-44(9)35-36-45-33-18-34-46(49-10)47(45)48/h18-19,21,23,25,27,29,31,33-35,48H,11-17,20,22,24,26,28,30,32,36H2,1-10H3/b38-21+,39-23+,40-25+,41-27+,42-29+,43-31+,44-35+ > MARGKPIMNMASKJ-CMAXTTDKSA-N > C47H72O2 > 669.091 > 668.553231558 > 2 > 121 > 87.19538398534257 > 0 > 1 > 0 > 0 > 2-methoxy-6-[(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]phenol > 9.82 > 14.858576152999996 > -6.49 > 0 > 1 > 0 > 9.7884599250942 > -4.892153646445838 > 29.46 > 225.3631 > 24 > 0 > 2.16e-04 g/l > 2-octaprenyl-6-methoxyphenol > 0 > ECMDB04119 > 2-Octaprenyl-6-methoxyphenol $$$$