Mrv1533004241517382D 34 36 0 0 0 0 999 V2000 0.0000 -4.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6131 -0.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8953 0.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 0.8017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6471 1.5770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5525 0.6585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6737 -0.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4862 -0.7488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0165 -0.1168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8289 -0.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7343 0.6585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0013 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7158 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4302 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7158 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0013 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0013 -3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 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 11 13 1 0 0 0 0 8 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 16 18 1 0 0 0 0 8 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 21 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 19 31 2 0 0 0 0 31 32 1 0 0 0 0 5 32 1 0 0 0 0 32 33 2 0 0 0 0 2 34 1 0 0 0 0 M END > NP0079913 > NP-MRD > CC(C)=CCC1=C(O)C(CC=C(C)C)(CC=C(C)C)C2=C(C(O)=C3C(O)=CC(C)=CC3=C2)C1=O > InChI=1S/C30H36O4/c1-17(2)8-9-22-27(32)26-23(16-21-14-20(7)15-24(31)25(21)28(26)33)30(29(22)34,12-10-18(3)4)13-11-19(5)6/h8,10-11,14-16,31,33-34H,9,12-13H2,1-7H3 > JPYKYGKPHWIDPA-UHFFFAOYSA-N > C30H36O4 > 460.614 > 460.261359639 > 4 > 70 > 52.878719611573686 > 1 > 3 > 0 > 0 > 3,8,9-trihydroxy-6-methyl-2,4,4-tris(3-methylbut-2-en-1-yl)-1,4-dihydroanthracen-1-one > 5.84 > 7.781922297333335 > -5.43 > 1 > 3 > -1 > 8.183509163651422 > 5.142485991947236 > -6.057881903549679 > 77.75999999999999 > 143.7511 > 6 > 0 > 1.72e-03 g/l > 3,8,9-trihydroxy-6-methyl-2,4,4-tris(3-methylbut-2-en-1-yl)anthracen-1-one > 0 > NP0079913 > Ferruginin B $$$$