Mrv0541 11051313202D 42 45 0 0 0 0 999 V2000 6.5621 -5.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9770 -6.0187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3843 -5.4295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9770 -6.8426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5661 -7.4261 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9699 -6.0110 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1449 -4.7173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2631 -5.6046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5609 -3.9998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5473 -6.0182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2494 -8.1877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7366 -5.6959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3901 -7.4261 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9735 -6.8368 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6706 -8.8983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3828 -4.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 -4.7120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2648 -7.2581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5577 -5.6660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5452 -6.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2696 -9.6143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3024 -3.2162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6391 -3.2138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9684 -2.7284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4911 -8.8869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9388 -4.9343 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4453 -9.6237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3691 -4.4356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 -4.8277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9962 -6.3621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8314 -5.6078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8314 -7.2557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7091 -8.1855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7353 -7.1536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6870 -10.3229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0222 -8.9169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8192 -6.3286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6134 -7.0882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2271 -3.6202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1645 -4.6844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1175 -6.0177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8331 -8.0851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 1 2 0 0 0 0 2 4 1 1 0 0 0 5 4 1 0 0 0 0 6 3 1 0 0 0 0 1 7 1 1 0 0 0 8 2 2 0 0 0 0 9 7 2 0 0 0 0 10 8 1 0 0 0 0 5 11 1 1 0 0 0 6 12 1 6 0 0 0 13 5 1 0 0 0 0 14 6 1 0 0 0 0 15 11 1 0 0 0 0 16 9 1 1 0 0 0 17 3 1 0 0 0 0 18 4 2 0 0 0 0 19 12 1 0 0 0 0 20 18 1 1 0 0 0 21 15 1 0 0 0 0 22 9 1 0 0 0 0 23 16 1 0 0 0 0 24 22 1 0 0 0 0 25 15 2 0 0 0 0 26 19 2 0 0 0 0 27 21 2 0 0 0 0 28 7 1 0 0 0 0 29 8 1 0 0 0 0 30 19 1 0 0 0 0 31 10 1 0 0 0 0 32 20 1 0 0 0 0 13 33 1 6 0 0 0 14 34 1 6 0 0 0 35 21 1 0 0 0 0 36 27 1 0 0 0 0 37 30 1 0 0 0 0 38 30 1 0 0 0 0 39 28 1 0 0 0 0 40 29 1 0 0 0 0 41 31 1 0 0 0 0 42 32 1 0 0 0 0 17 16 2 0 0 0 0 14 13 1 0 0 0 0 24 23 1 0 0 0 0 10 20 2 0 0 0 0 M END > CHEBI:67450 > ananolignan M > A lignan with a dibenzocyclooctadiene skeleton isolated from Kadsura ananosma. > 3 > (5R,6S,7R,8R)-8-(isobutyryloxy)-1,2,3,13-tetramethoxy-6,7-dimethyl-5,6,7,8-tetrahydrobenzo[3',4']cycloocta[1',2':4,5]benzo[1,2-d][1,3]dioxol-5-yl (2Z)-2-methylbut-2-enoate > C32H40O10 > 584.65400 > 584.26215 > 0 > COc1cc2[C@H](OC(=O)C(\C)=C/C)[C@@H](C)[C@@H](C)[C@@H](OC(=O)C(C)C)c3cc4OCOc4c(OC)c3-c2c(OC)c1OC > InChI=1S/C32H40O10/c1-11-16(4)32(34)42-26-18(6)17(5)25(41-31(33)15(2)3)20-13-22-28(40-14-39-22)30(38-10)24(20)23-19(26)12-21(35-7)27(36-8)29(23)37-9/h11-13,15,17-18,25-26H,14H2,1-10H3/b16-11-/t17-,18+,25-,26-/m1/s1 > BEKCLGHIGPWWEG-KDTPNPLXSA-N > 21534268 > 21381710 $$$$