Mrv1652309122216442D 29 31 0 0 0 0 999 V2000 4.9050 4.4059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0783 3.5993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8635 3.3461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4665 3.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6813 3.2991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6398 2.2393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 1.6859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3126 2.0968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4923 2.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7769 2.4196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 2.8161 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8804 1.4553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7107 0.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -0.1050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7633 -0.5159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5936 -1.3232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5836 -0.4278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1955 0.1256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9109 -0.2853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5227 0.2681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.0984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1855 1.0211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5964 1.7364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4214 1.7383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8323 2.4537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4182 3.1672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6573 2.4555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3652 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5683 0.5801 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 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 17 15 1 4 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 22 28 2 0 0 0 0 18 28 1 0 0 0 0 7 28 1 0 0 0 0 15 29 1 0 0 0 0 12 29 1 0 0 0 0 M END > NP0329893 > NP-MRD > CC(=O)OCC1=C2C(CC(C)(O)C3=CCC(C)(O3)C=C2OC1=O)OC(=O)C(C)=C > InChI=1S/C21H24O8/c1-11(2)18(23)27-15-9-21(5,25)16-6-7-20(4,29-16)8-14-17(15)13(19(24)28-14)10-26-12(3)22/h6,8,15,25H,1,7,9-10H2,2-5H3 > FRUDCXFMEKMPEW-UHFFFAOYSA-N > C21H24O8 > 404.415 > 404.147117733 > 5 > 53 > 40.119880508238666 > 1 > 1 > 0 > 1 > 6-[(acetyloxy)methyl]-10-hydroxy-1,10-dimethyl-5-oxo-4,14-dioxatricyclo[9.2.1.0^{3,7}]tetradeca-2,6,11-trien-8-yl 2-methylprop-2-enoate > 0.9227041143333343 > 1 > 3 > 0 > 13.687951650562745 > -3.3726899480438544 > 108.36000000000003 > 103.88609999999998 > 6 > 1 > 6-[(acetyloxy)methyl]-10-hydroxy-1,10-dimethyl-5-oxo-4,14-dioxatricyclo[9.2.1.0^{3,7}]tetradeca-2,6,11-trien-8-yl 2-methylprop-2-enoate > 0 > NP0329893 > 6-[(acetyloxy)methyl]-10-hydroxy-1,10-dimethyl-5-oxo-4,14-dioxatricyclo[9.2.1.0³,⁷]tetradeca-2,6,11-trien-8-yl 2-methylprop-2-enoate $$$$