3,4,5-Trimethoxycinnamic acid http://gmd-dev.mpimp-golm.mpg.de/search.aspx?query=d2c93c07-c596-4546-8ce6-b01a904d5ca4 31 31 0 0 0 0 0 0 0999 V2000 4.5981 -3.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 -3.0231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 -4.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.0231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5062 -2.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8862 -1.0231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 14 1 0 0 0 0 2 8 1 0 0 0 0 2 15 1 0 0 0 0 3 9 1 0 0 0 0 3 16 1 0 0 0 0 4 17 1 0 0 0 0 4 31 1 0 0 0 0 5 17 2 0 0 0 0 6 10 2 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 10 1 0 0 0 0 9 11 2 0 0 0 0 10 18 1 0 0 0 0 11 19 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 17 1 0 0 0 0 13 21 1 0 0 0 0 14 22 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 M END > 735755 > 1 > 262 > 5 > 1 > 5 > AAADccBwOAAAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGgAACAAADASAmAIyDoAABgCIAiDSCAACCAAgIAAIiAAGiMgNJyKEMRqAMCIlwBUKuYeA4BwOIAABCAAAQABAAAIQAACAAAAAAAAAAA== > (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid > (E)-3-(3,4,5-trimethoxyphenyl)-2-propenoic acid > (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid > (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid > (E)-3-(3,4,5-trimethoxyphenyl)acrylic acid > InChI=1S/C12H14O5/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H,13,14)/b5-4+ > YTFVRYKNXDADBI-SNAWJCMRSA-N > 1.4 > 238.084124 > C12H14O5 > 238.23656 > COC1=CC(=CC(=C1OC)OC)C=CC(=O)O > COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)O > 65 > 238.084124 > 0 > 17 > 0 > 0 > 1 > 0 > 0 > 1 > 1 > 1 3 > 6 10 8 6 11 8 7 8 8 7 9 8 8 10 8 9 11 8