Mrv1652309122214002D 22 22 0 0 0 0 999 V2000 7.7125 1.9393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9980 2.3518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9980 3.1768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2835 1.9393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5691 2.3518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8546 1.9393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1401 2.3518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1401 3.1768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4256 1.9393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7112 2.3518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9967 1.9393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2822 2.3518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2822 3.1768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5678 1.9393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5678 1.1143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2352 0.6294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9803 -0.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1553 -0.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0997 0.6294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8843 0.8843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4974 0.3323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0558 1.6913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 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 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 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 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 15 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 M END > NP0328492 > NP-MRD > CC(C)C1=C(C\C(C)=C\CC\C(C)=C\CCC(C)=O)OC=C1 > InChI=1S/C20H30O2/c1-15(2)19-12-13-22-20(19)14-17(4)10-6-8-16(3)9-7-11-18(5)21/h9-10,12-13,15H,6-8,11,14H2,1-5H3/b16-9+,17-10+ > DRMKQMUOMUJTSW-CZCYGEDCSA-N > C20H30O2 > 302.458 > 302.224580206 > 1 > 52 > 37.19425560364168 > 1 > 0 > 0 > 1 > (5E,9E)-6,10-dimethyl-11-[3-(propan-2-yl)furan-2-yl]undeca-5,9-dien-2-one > 5.409396512666667 > 0 > 1 > 0 > 19.598762051814717 > -2.8149406742616074 > 30.21 > 95.2576 > 9 > 0 > (5E,9E)-11-(3-isopropylfuran-2-yl)-6,10-dimethylundeca-5,9-dien-2-one > 1 > NP0328492 > (5e,9e)-11-(3-isopropylfuran-2-yl)-6,10-dimethylundeca-5,9-dien-2-one $$$$