Mrv1533004171520152D 24 28 0 0 0 0 999 V2000 -0.4456 -1.3924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1392 -0.8105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7092 -1.4069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4757 -0.2170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1077 0.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9123 0.1725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 1.1347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 1.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1062 1.8979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8213 1.4674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5396 1.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2706 1.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9673 0.9712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6983 1.3535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3950 0.9116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 1.2939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3605 0.0873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6294 -0.2950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9328 0.1470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2017 -0.2354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1673 -1.0596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5051 0.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -0.2343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1511 0.2836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 13 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 11 22 1 0 0 0 0 22 23 1 0 0 0 0 2 23 1 0 0 0 0 23 24 1 0 0 0 0 4 24 1 0 0 0 0 8 24 1 0 0 0 0 M END > NP0276578 > NP-MRD > CC1(C)C2C3C1C1=C(O)C4=C(OC(=O)C=C4)C=C1OC3(C)CC2O > InChI=1S/C19H20O5/c1-18(2)14-9(20)7-19(3)16(14)15(18)13-11(24-19)6-10-8(17(13)22)4-5-12(21)23-10/h4-6,9,14-16,20,22H,7H2,1-3H3 > ZSTCJSXZGHSBEH-UHFFFAOYSA-N > C19H20O5 > 328.364 > 328.131073744 > 4 > 44 > 33.92811684084225 > 1 > 2 > 0 > 1 > 3,15-dihydroxy-13,17,17-trimethyl-8,12-dioxapentacyclo[11.4.1.0²,¹¹.0⁴,⁹.0¹⁶,¹⁸]octadeca-2,4(9),5,10-tetraen-7-one > 2.64 > 1.798752249333333 > -3.37 > 0 > 5 > 0 > 14.823807375029247 > 8.006434392361689 > -2.875869075464805 > 75.99 > 87.4203 > 0 > 1 > 1.40e-01 g/l > 3,15-dihydroxy-13,17,17-trimethyl-8,12-dioxapentacyclo[11.4.1.0²,¹¹.0⁴,⁹.0¹⁶,¹⁸]octadeca-2,4(9),5,10-tetraen-7-one > 0 > NP0276578 > 3,15-dihydroxy-13,17,17-trimethyl-8,12-dioxapentacyclo[11.4.1.0²,¹¹.0⁴,⁹.0¹⁶,¹⁸]octadeca-2(11),3,5,9-tetraen-7-one $$$$