70491497 -OEChem-03182423262D 60 60 0 1 0 0 0 0 0999 V2000 12.3660 -1.7320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3660 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -3.9641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 -4.8301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0000 -0.3660 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0000 -1.3660 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.8660 -0.8660 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5000 -2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8660 -0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 -2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -3.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 -3.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 -3.9641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 3.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 3.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 3.9641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 3.9641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4384 0.0724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4384 -1.8044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0265 -0.2672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0826 0.7121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3923 1.1106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3923 -2.8426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0826 -2.4441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9174 0.2879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6077 -0.1106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6077 -1.6215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9174 -2.0200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5826 1.5781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8923 1.9766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8923 -3.7087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5826 -3.3101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9860 -1.7320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4174 1.1540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1077 0.7554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1077 -2.4875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4174 -2.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0826 2.4441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3923 2.8426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9174 2.0200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6077 1.6215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5826 3.3101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8923 3.7087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4174 2.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1077 2.4875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0826 4.1762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3923 4.5747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1900 -4.5010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9174 3.7520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6077 3.3535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 5.1401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 5.3671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 4.5201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 40 1 0 0 0 0 2 10 2 0 0 0 0 3 19 1 0 0 0 0 3 55 1 0 0 0 0 4 19 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 26 1 0 0 0 0 7 10 1 0 0 0 0 7 27 1 0 0 0 0 8 11 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 12 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 14 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 15 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 16 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 17 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 19 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 20 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 M END > 70491497 > 1 > 367 > 4 > 2 > 16 > AAADcfB4OAAAAAAAAAAAAAAAGAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAADQCAgAACCAAAAgAIAACQCAAAAAAAAAAAAAEAAAAAABIAAAAAQAAEAAAAAAGIyOCOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > 2-(4-carboxybutyl)-3-undecyl-cyclopropanecarboxylic acid > 2-(4-carboxybutyl)-3-undecyl-1-cyclopropanecarboxylic acid > 2-(4-carboxybutyl)-3-undecylcyclopropane-1-carboxylic acid > 2-(4-carboxybutyl)-3-undecylcyclopropane-1-carboxylic acid > 2-(5-oxidanyl-5-oxidanylidene-pentyl)-3-undecyl-cyclopropane-1-carboxylic acid > 2-(4-carboxybutyl)-3-undecyl-cyclopropanecarboxylic acid > InChI=1S/C20H36O4/c1-2-3-4-5-6-7-8-9-10-13-16-17(19(16)20(23)24)14-11-12-15-18(21)22/h16-17,19H,2-15H2,1H3,(H,21,22)(H,23,24) > UTDVYHIHNBYUQC-UHFFFAOYSA-N > 6.9 > 340.26135963 > C20H36O4 > 340.5 > CCCCCCCCCCCC1C(C1C(=O)O)CCCCC(=O)O > CCCCCCCCCCCC1C(C1C(=O)O)CCCCC(=O)O > 74.6 > 340.26135963 > 0 > 24 > 0 > 3 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 5 8 3 6 9 3 7 10 3 $$$$