444539 -OEChem-02210610412D 19 19 0 0 0 0 0 0 0999 V2000 2.8660 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 1 12 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 3 5 2 0 0 0 0 3 14 1 0 0 0 0 4 8 2 0 0 0 0 4 15 1 0 0 0 0 5 8 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 19 1 0 0 0 0 M END > 1 > 444539 > 2 > 1 > 2 > AAADcQAwcMAAAAAAAAAAAAAAAAAAAAAAADAAAAAAAAABAAAAGgAAAAAIAACAAAwACDAAmAACAIDSIAKIAAIACAAAIAAAAIgIJAjIABARgCIgADCAmQgAgICAAIcAAAAOAAAAAAAAAAAAAAAAAAAAAAAAAA== > cinnamic acid > cinnamic acid > (E)-3-phenylprop-2-enoic acid > cinnamic acid > InChI=1/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)/b7-6+/f/h10H > 2.098 > C9H8O2 > 148.159 > C1=CC=C(C=C1)C=CC(=O)O > C1=CC=C(C=C1)\C=C\C(=O)O > 37.3 > 0 > 11 > 0 > 0 > 1 > 0 > 0 > 1 > 1 > 3713 > 2 > KEGG > C00423 > Is a reactant or product of enzyme EC 1.3.1.31 Is a reactant or product of enzyme EC 1.14.12.- Is a reactant or product of enzyme EC 1.14.13.11 Is a reactant or product of enzyme EC 1.14.13.14 Is a reactant or product of enzyme EC 2.4.1.177 Is a reactant or product of enzyme EC 4.3.1.5 Is a reactant or product of enzyme EC 6.2.1.12 > 140-10-3 C00423 trans-Cinnamate trans-Cinnamic acid > 140-10-3 > C00423 > 56553831 56553832 56553834 56553835 56553836 56553837 56553838 56553839 56553840 56553841 56966620 56966621 > http://www.genome.jp/kegg/kegg2.html > http://www.genome.jp/dbget-bin/www_bget?cpd+C00423 > 444539 1 > 1 2 8 1 3 8 2 4 8 3 5 8 4 8 8 5 8 8 $$$$