Mrv1652309042000362D 15 15 0 0 0 0 999 V2000 8.8552 -17.7674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8552 -18.5925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1407 -17.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1407 -19.0050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4262 -17.7674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4262 -18.5925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7118 -19.0050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5697 -17.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2842 -17.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9987 -17.3548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7131 -17.7673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7118 -17.3550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1407 -19.8299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4262 -20.2425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9973 -17.7674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 1 2 0 0 0 0 4 2 2 0 0 0 0 5 3 1 0 0 0 0 6 4 1 0 0 0 0 6 5 2 0 0 0 0 6 7 1 0 0 0 0 1 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 5 12 1 0 0 0 0 4 13 1 0 0 0 0 13 14 1 0 0 0 0 12 15 1 0 0 0 0 M END > CDB005039 > CDB > COC1=CC(\C=C\CO)=CC(OC)=C1O > InChI=1S/C11H14O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-4,6-7,12-13H,5H2,1-2H3/b4-3+ > LZFOPEXOUVTGJS-ONEGZZNKSA-N > C11H14O4 > 210.2265 > 210.089208936 > 4 > 29 > 22.264326193207896 > 1 > 2 > 0 > 1 > 4-[(1E)-3-hydroxyprop-1-en-1-yl]-2,6-dimethoxyphenol > 1.36 > 1.1969038689999996 > -2.26 > 0 > 1 > 0 > 15.622941615126049 > 9.401172317181906 > -2.526481495671672 > 58.92 > 58.09980000000001 > 4 > 1 > 1.15e+00 g/l > sinapyl alcohol > 0 > CDB005039 > Sinapyl alcohol $$$$