Marvin 07081312252D 50 58 0 0 0 0 999 V2000 5.2966 0.1336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4696 0.1336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 -0.5826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4694 -2.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1875 -1.9569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1846 -1.1241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4676 -0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7526 -1.9573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7568 -1.1323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0484 -0.7186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3318 -1.1268 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6252 -0.7134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3302 -1.9477 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6159 -2.3600 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6158 -3.1803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3283 -3.5945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0429 -3.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0446 -2.3556 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9046 -1.9421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9105 -1.1201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2027 -0.7057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5115 -1.1124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5134 -1.9376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -2.3481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3266 -0.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3185 1.3622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5997 0.9381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6081 0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0408 0.9507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0451 0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7578 -0.2807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4664 0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7490 1.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8939 -2.7653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7552 -2.7653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -1.5289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3271 -4.4216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8995 -0.7078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2285 -0.6983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3115 0.1245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9855 -1.0316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5364 -0.4148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1207 0.2972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5293 1.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3535 1.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7672 0.2975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3562 -0.4135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5944 0.2973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1928 -3.1752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3123 2.1893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23 24 2 0 0 0 0 24 19 1 0 0 0 0 5 6 1 0 0 0 0 11 25 1 1 0 0 0 25 30 1 0 0 0 0 11 12 1 0 0 0 0 29 26 1 0 0 0 0 12 20 1 0 0 0 0 26 27 2 0 0 0 0 19 14 1 0 0 0 0 27 28 1 0 0 0 0 28 25 2 0 0 0 0 29 30 2 0 0 0 0 13 14 1 0 0 0 0 6 7 2 0 0 0 0 7 9 1 0 0 0 0 8 9 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 31 2 1 0 0 0 0 2 32 1 0 0 0 0 32 33 2 0 0 0 0 8 4 1 0 0 0 0 14 34 1 1 0 0 0 2 1 1 0 0 0 0 18 35 1 1 0 0 0 13 18 1 0 0 0 0 13 36 1 6 0 0 0 14 15 1 0 0 0 0 16 37 1 0 0 0 0 15 16 2 0 0 0 0 6 38 1 0 0 0 0 39 40 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 4 5 2 0 0 0 0 40 43 1 0 0 0 0 42 41 1 0 0 0 0 41 39 1 0 0 0 0 22 39 1 0 0 0 0 8 18 1 0 0 0 0 19 20 2 0 0 0 0 42 43 2 0 0 0 0 9 10 1 0 0 0 0 43 44 1 0 0 0 0 20 21 1 0 0 0 0 44 45 2 0 0 0 0 10 11 1 0 0 0 0 45 46 1 0 0 0 0 21 22 2 0 0 0 0 46 47 2 0 0 0 0 47 42 1 0 0 0 0 13 11 1 0 0 0 0 46 48 1 0 0 0 0 22 23 1 0 0 0 0 24 49 1 0 0 0 0 3 2 1 0 0 0 0 26 50 1 0 0 0 0 M END > CHEBI:66514 > sorocenol G > An organic heteropentacyclic compound isolated from Sorocea muriculata and has been shown to exhibit antibacterial activity against methicillin-resistant Staphylococcus aureus. > 3 > (3aS,8aR,13bR,13cS)-6-(6-hydroxy-1-benzofuran-2-yl)-8a-(5-hydroxy-2,2-dimethyl-2H-chromen-8-yl)-2-methyl-1,8a,13b,13c-tetrahydro-3aH-benzo[3,4]isochromeno[1,8-bc]chromene-4,11-diol > C39H32O8 > 628.66660 > 628.20972 > 0 > [H][C@]12CC(C)=C[C@]3([H])c4c(O)cc(cc4O[C@@](Oc4cc(O)ccc14)(c1ccc(O)c4C=CC(C)(C)Oc14)[C@@]23[H])-c1cc2ccc(O)cc2o1 > InChI=1S/C39H32O8/c1-19-12-26-24-7-6-23(41)18-33(24)45-39(28-8-9-29(42)25-10-11-38(2,3)47-37(25)28)36(26)27(13-19)35-30(43)14-21(16-34(35)46-39)31-15-20-4-5-22(40)17-32(20)44-31/h4-11,13-18,26-27,36,40-43H,12H2,1-3H3/t26-,27+,36-,39-/m0/s1 > GOBAQYCCUYZMJY-HGLYATPPSA-N > 19203597 > 18847244 $$$$