Ketcher 02261812022D 1 1.00000 0.00000 0 59 60 0 0 0 999 V2000 1.0816 -4.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0816 -5.2974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9475 -3.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8134 -4.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9475 -2.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0816 -2.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0816 -1.2976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2154 -2.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6507 -2.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5166 -2.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5166 -3.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6507 -4.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2154 -3.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8134 -2.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6796 -2.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5457 -2.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5457 -1.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4117 -2.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2775 -2.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1437 -2.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0096 -2.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0096 -1.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8757 -2.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7418 -2.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6077 -2.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4740 -2.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4740 -1.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3398 -2.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2057 -2.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0720 -2.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9379 -2.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9379 -1.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8040 -2.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8041 -3.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9379 -4.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9382 -5.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8042 -5.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0721 -5.7975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0724 -6.7975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2063 -7.2977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2066 -8.2978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0727 -8.7976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3406 -8.7979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4746 -8.2983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6087 -8.7985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7425 -8.2985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8766 -8.7989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7422 -7.2985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0103 -8.2989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1444 -8.7991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 -8.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4122 -8.7995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2780 -7.2993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5462 -8.2997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6802 -8.7999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8139 -8.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9481 -8.8002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8139 -7.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0819 -8.3003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 1 3 1 0 0 0 1 13 1 0 0 0 3 4 1 0 0 0 3 5 2 0 0 0 5 6 1 0 0 0 5 14 1 0 0 0 6 7 2 0 0 0 6 8 1 0 0 0 8 9 2 0 0 0 8 13 1 0 0 0 9 10 1 0 0 0 10 11 2 0 0 0 11 12 1 0 0 0 12 13 2 0 0 0 14 15 1 0 0 0 15 16 2 0 0 0 16 17 1 0 0 0 16 18 1 0 0 0 18 19 1 0 0 0 19 20 1 0 0 0 20 21 1 0 0 0 21 22 1 0 0 0 21 23 1 0 0 0 23 24 1 0 0 0 24 25 1 0 0 0 25 26 2 0 0 0 26 27 1 0 0 0 26 28 1 0 0 0 28 29 1 0 0 0 29 30 1 0 0 0 30 31 2 0 0 0 31 32 1 0 0 0 31 33 1 0 0 0 33 34 1 0 0 0 34 35 1 0 0 0 35 36 2 0 0 0 36 37 1 0 0 0 36 38 1 0 0 0 38 39 1 0 0 0 39 40 1 0 0 0 40 41 2 0 0 0 41 42 1 0 0 0 41 43 1 0 0 0 43 44 1 0 0 0 44 45 1 0 0 0 45 46 2 0 0 0 46 47 1 0 0 0 46 48 1 0 0 0 47 49 1 0 0 0 49 50 1 0 0 0 50 51 2 0 0 0 51 52 1 0 0 0 51 53 1 0 0 0 52 54 1 0 0 0 54 55 1 0 0 0 55 56 2 0 0 0 56 57 1 0 0 0 56 58 1 0 0 0 57 59 1 0 0 0 M END > CHEBI:140189 > omega-hydroxy-beta-dihydromenaquinone-9 > A member of the class of menaquinones that is menaquinone-9 in which the double bond that is second nearest to the naphthoquinone moiety has been dihydrogenated and one of the terminal methyl hydrogens has been replaced by a hydroxy group. > 3 > omega-hydroxy-beta-dihydromenaquinone-9 > 2-[(2E,10E,14E,18E,22E,26E,30E,34E)-36-hydroxy-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,10,14,18,22,26,30,34-octaen-1-yl]-3-methylnaphthalene-1,4-dione > C56H82O3 > 803.251 > 802.62640 > 0 > C1(=O)C(C)=C(C(=O)C2=CC=CC=C12)C/C=C(\C)/CCCC(C)CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(/CC/C=C(/CC/C=C(/CO)\C)\C)\C > InChI=1S/C56H82O3/c1-42(22-14-24-44(3)26-16-28-46(5)30-18-32-48(7)34-20-36-50(9)41-57)21-13-23-43(2)25-15-27-45(4)29-17-31-47(6)33-19-35-49(8)39-40-52-51(10)55(58)53-37-11-12-38-54(53)56(52)59/h11-12,21,24-25,28-29,32,36-39,47,57H,13-20,22-23,26-27,30-31,33-35,40-41H2,1-10H3/b42-21+,43-25+,44-24+,45-29+,46-28+,48-32+,49-39+,50-36+ > SIXCRFGMVUATBG-HSHHTCJHSA-N > CPD-18194 > 18928249; 27933784 $$$$