CDK 1030232201 21 25 0 0 0 0 0 0 0 0999 V2000 4.9851 0.8774 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1933 1.1092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9982 1.9108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5967 0.5394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2065 2.1426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8049 0.7712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6098 1.5729 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2083 0.2015 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4147 2.3745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8181 1.8047 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2831 -0.6468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4165 0.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9803 -0.0893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2214 1.2349 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6302 -1.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3987 1.2970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -0.8378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0855 0.5338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7162 0.3387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 4 6 2 0 0 0 0 7 5 1 0 0 0 0 8 6 1 0 0 0 0 7 9 1 1 0 0 0 10 7 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 6 0 0 0 14 10 1 0 0 0 0 11 15 2 0 0 0 0 16 12 1 0 0 0 0 14 17 1 6 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 16 20 1 1 0 0 0 19 21 2 0 0 0 0 6 7 1 0 0 0 0 10 9 1 1 0 0 0 12 14 1 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 M END > CHEBI:216468 > (1S,2R,4R,10S,14S)-10,14-dimethyl-3,6,16-trioxapentacyclo[8.6.1.02,4.04,9.014,17]heptadeca-8,11-diene-7,15-dione > 2 > (1S,2R,4R,10S,14S)-10,14-dimethyl-3,6,16-trioxapentacyclo[8.6.1.02,4.04,9.014,17]heptadeca-8,11-diene-7,15-dione > C16H16O5 > 288.299 > 288.09977 > 0 > O=C1OC[C@@]23O[C@@H]2[C@H]4OC([C@@]5(C4[C@@](C3=C1)(C=CC5)C)C)=O > InChI=1S/C16H16O5/c1-14-4-3-5-15(2)11(14)10(20-13(15)18)12-16(21-12)7-19-9(17)6-8(14)16/h3-4,6,10-12H,5,7H2,1-2H3/t10-,11?,12+,14+,15-,16-/m0/s1 > SSBCRFWUKNDCSZ-ANZWRPDSSA-N $$$$