70491167 -OEChem-05082414182D 75 75 0 1 0 0 0 0 0999 V2000 14.8660 -1.7320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8660 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 -4.8301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -5.6962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5000 -0.3660 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.5000 -1.3660 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3660 -0.8660 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.0000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 -2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3660 -0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0000 -2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -3.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5000 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5000 -3.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -3.9641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -3.9641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 3.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 3.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 3.9641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -4.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 3.9641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 4.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 4.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 5.6962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.6962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9384 0.0724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9384 -1.8044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5265 -0.2672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5826 0.7121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8923 1.1106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8923 -2.8426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5826 -2.4441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4174 0.2879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1077 -0.1106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1077 -1.6215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4174 -2.0200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0826 1.5781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 1.9766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -3.7087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0826 -3.3101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4860 -1.7320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9174 1.1540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6077 0.7554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6077 -2.4875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9174 -2.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5826 2.4441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8923 2.8426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8923 -4.5747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5826 -4.1762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4174 2.0200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1077 1.6215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1077 -3.3535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4174 -3.7520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0826 3.3101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3923 3.7087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9174 2.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6077 2.4875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5826 4.1762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8923 4.5747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4174 3.7520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1077 3.3535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0826 5.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3923 5.4407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9174 4.6181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6077 4.2196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1900 -5.3671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5826 5.9082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8923 6.3067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 6.3162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 5.6962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.0762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 45 1 0 0 0 0 2 10 2 0 0 0 0 3 24 1 0 0 0 0 3 70 1 0 0 0 0 4 24 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 30 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 31 1 0 0 0 0 7 10 1 0 0 0 0 7 32 1 0 0 0 0 8 11 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 12 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 11 13 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 14 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 15 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 16 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 17 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 18 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 19 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 20 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 21 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 24 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 58 1 0 0 0 0 21 59 1 0 0 0 0 22 23 1 0 0 0 0 22 60 1 0 0 0 0 22 61 1 0 0 0 0 23 25 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 25 26 1 0 0 0 0 25 64 1 0 0 0 0 25 65 1 0 0 0 0 26 27 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 27 28 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 28 29 1 0 0 0 0 28 71 1 0 0 0 0 28 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 29 75 1 0 0 0 0 M END > 70491167 > 1 > 435 > 4 > 2 > 21 > AAADcfB4OAAAAAAAAAAAAAAAGAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAADQCAgAACCAAAAgAIAACQCAAAAAAAAAAAAAEAAAAAABIAAAAAQAAEAAAAAAGIyOCOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > 2-(6-carboxyhexyl)-3-tetradecyl-cyclopropanecarboxylic acid > 2-(6-carboxyhexyl)-3-tetradecyl-1-cyclopropanecarboxylic acid > 2-(6-carboxyhexyl)-3-tetradecylcyclopropane-1-carboxylic acid > 2-(6-carboxyhexyl)-3-tetradecylcyclopropane-1-carboxylic acid > 2-(7-oxidanyl-7-oxidanylidene-heptyl)-3-tetradecyl-cyclopropane-1-carboxylic acid > 2-(6-carboxyhexyl)-3-myristyl-cyclopropanecarboxylic acid > InChI=1S/C25H46O4/c1-2-3-4-5-6-7-8-9-10-11-12-15-18-21-22(24(21)25(28)29)19-16-13-14-17-20-23(26)27/h21-22,24H,2-20H2,1H3,(H,26,27)(H,28,29) > OJISXISOWWAIEF-UHFFFAOYSA-N > 9.6 > 410.33960994 > C25H46O4 > 410.6 > CCCCCCCCCCCCCCC1C(C1C(=O)O)CCCCCCC(=O)O > CCCCCCCCCCCCCCC1C(C1C(=O)O)CCCCCCC(=O)O > 74.6 > 410.33960994 > 0 > 29 > 0 > 3 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 5 8 3 6 9 3 7 10 3 $$$$