Mrv1533004171520282D 14 15 0 0 0 0 999 V2000 5.0013 3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 3.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 2.8875 0.0000 O 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 2 0 0 0 0 5 6 2 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 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 6 13 1 0 0 0 0 13 14 1 0 0 0 0 M END > NP0306328 > NP-MRD > CC(=C)C=C=C1CC(O)C2OC2C1O > InChI=1S/C11H14O3/c1-6(2)3-4-7-5-8(12)10-11(14-10)9(7)13/h3,8-13H,1,5H2,2H3 > DCINRHBECZLNMG-UHFFFAOYSA-N > C11H14O3 > 194.23 > 194.094294311 > 3 > 28 > 20.39386101773956 > 1 > 2 > 0 > 1 > 3-(3-methylbuta-1,3-dien-1-ylidene)-7-oxabicyclo[4.1.0]heptane-2,5-diol > 0.33 > 0.3204659020000002 > -1.50 > 0 > 2 > 0 > 14.09595602652934 > 13.170821143886695 > -3.2293354346942458 > 52.989999999999995 > 52.9043 > 1 > 1 > 6.14e+00 g/l > 3-(3-methylbuta-1,3-dien-1-ylidene)-7-oxabicyclo[4.1.0]heptane-2,5-diol > 0 > NP0306328 > 3-(3-methylbuta-1,3-dien-1-ylidene)-7-oxabicyclo[4.1.0]heptane-2,5-diol $$$$