46218222 -OEChem-03292401482D 72 70 0 0 0 0 0 0 0999 V2000 0.5369 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 11.8469 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 11.8469 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 10.3469 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 11.8469 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 10.3469 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4651 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3312 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1972 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3312 6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1972 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3312 7.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1972 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1972 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0632 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0632 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4651 7.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4651 11.3469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 12.8469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 11.3469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 11.3469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4685 0.5251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2656 0.5251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1316 1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3346 1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3996 1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6025 1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2006 0.5251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9976 0.5251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7365 0.5251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5335 0.5251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8637 1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0666 1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6675 1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8705 1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3312 0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8078 5.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4092 6.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7206 6.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1191 5.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5866 4.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9851 3.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9417 6.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5432 7.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7341 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9851 3.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5866 2.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6002 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6002 2.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7751 8.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9282 7.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1551 6.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1551 10.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0021 11.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7751 11.8839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2191 12.8469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 13.4669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9791 12.8469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2700 10.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 11.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 12.4669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 10.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 10.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 61 1 0 0 0 0 2 22 2 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 28 1 0 0 0 0 4 29 2 0 0 0 0 5 28 2 0 0 0 0 5 68 1 0 0 0 0 6 29 1 0 0 0 0 6 69 1 0 0 0 0 6 70 1 0 0 0 0 7 29 1 0 0 0 0 7 71 1 0 0 0 0 7 72 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 11 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 12 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 13 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 14 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 15 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 22 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 20 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 19 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 23 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 25 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 21 24 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 23 24 2 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 27 65 1 0 0 0 0 27 66 1 0 0 0 0 27 67 1 0 0 0 0 M END > 46218222 > 1 > 399 > 3 > 4 > 16 > AAADcfB7sAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHgAQCAAACACAgAQDCANAAgCoACDSLAAAAAGgAAAJCAEIAAiAABIAAQAAQAAEgAAIAAOIyKCAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > 3-(diaminomethylene)-1,1-dimethyl-guanidine;(9Z,12Z)-octadeca-9,12-dienoic acid > 3-(diaminomethylidene)-1,1-dimethylguanidine;(9Z,12Z)-octadeca-9,12-dienoic acid > 3-(diaminomethylidene)-1,1-dimethylguanidine;(9Z,12Z)-octadeca-9,12-dienoic acid > 3-(diaminomethylidene)-1,1-dimethylguanidine;(9Z,12Z)-octadeca-9,12-dienoic acid > 3-[bis(azanyl)methylidene]-1,1-dimethyl-guanidine;(9Z,12Z)-octadeca-9,12-dienoic acid > 3-(diaminomethylene)-1,1-dimethyl-guanidine;(9Z,12Z)-octadeca-9,12-dienoic acid > InChI=1S/C18H32O2.C4H11N5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-9(2)4(7)8-3(5)6/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20);1-2H3,(H5,5,6,7,8)/b7-6-,10-9-; > USDMBGRGXTZLOO-NBTZWHCOSA-N > 409.34167563 > C22H43N5O2 > 409.6 > CCCCCC=CCC=CCCCCCCCC(=O)O.CN(C)C(=N)N=C(N)N > CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CN(C)C(=N)N=C(N)N > 129 > 409.34167563 > 0 > 29 > 0 > 0 > 2 > 0 > 0 > 2 > -1 > 1 5 255 $$$$