73820467 CDK 0602212313 39 45 0 0 0 0 0 0 0 0999 V2000 7.2998 -1.8663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3689 -1.4536 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4467 -0.7103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4058 0.7466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2182 0.0649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4238 1.5976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2907 -2.9170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6796 0.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4775 -0.9504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7237 2.8432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0597 2.6033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6914 -1.3158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9770 -0.9033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4058 -0.9033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5188 -2.1175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9770 -0.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6914 0.3341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4058 -0.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7031 -2.2025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2262 0.3398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4407 0.0255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7047 1.1934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2308 -0.9033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8183 -1.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2196 1.1991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9638 1.6288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4479 1.6526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4616 -0.1256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6727 1.2050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4771 2.5062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9614 2.4828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2259 2.9170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 2.0679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9567 1.6148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4334 2.4225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2043 1.2763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8673 2.4349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1525 2.8267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 1.8873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 15 1 0 0 0 0 2 13 1 0 0 0 0 2 19 1 0 0 0 0 3 16 1 0 0 0 0 4 17 1 0 0 0 0 5 18 2 0 0 0 0 6 22 1 0 0 0 0 6 35 1 0 0 0 0 7 19 2 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 28 2 0 0 0 0 10 35 2 0 0 0 0 11 37 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 13 21 1 0 0 0 0 14 18 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 20 25 2 0 0 0 0 20 28 1 0 0 0 0 22 26 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 31 2 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 27 33 1 0 0 0 0 29 34 1 0 0 0 0 30 32 1 0 0 0 0 31 32 1 0 0 0 0 34 36 1 0 0 0 0 34 37 2 0 0 0 0 35 38 1 0 0 0 0 36 39 2 0 0 0 0 M END > CHEBI:175982 > Dukunolide C > 2 > [18-(uran-3-yl)-2,11-dihydroxy-3,9,9,17-tetramethyl-5,10,20-trioxo-4,7,19-trioxahexacyclo[11.7.1.02,11.03,8.06,8.017,21]henicosa-1(21),13-dien-12-yl] acetate > C28H28O11 > 540.521 > 540.16316 > 0 > O1C23C(OC(=O)C12)(C4(O)C(O)(C(=O)C3(C)C)C(OC(=O)C)C=5C6=C4C(OC(C6(CCC5)C)C=7C=COC7)=O)C > InChI=1S/C28H28O11/c1-12(29)36-18-14-7-6-9-24(4)15(14)16(20(30)37-17(24)13-8-10-35-11-13)27(34)25(5)28(19(38-28)21(31)39-25)23(2,3)22(32)26(18,27)33/h7-8,10-11,17-19,33-34H,6,9H2,1-5H3 > HOJFTRARYIFTJU-UHFFFAOYSA-N $$$$