52326283 -OEChem-03282419312D 57 59 0 1 0 0 0 0 0999 V2000 4.5981 1.3988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3007 3.8933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6012 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.3301 1.3988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1012 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7320 -2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1097 2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 3.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2788 4.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2881 -0.0643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9081 -1.1382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -0.6838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 0.0064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -0.0643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -1.1382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 0.7911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 1.4814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 2.9814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 2.2911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -3.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.5643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.7912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.6382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 -4.6382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -4.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 -3.5643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -0.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2386 1.8856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -1.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3954 3.1704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5310 4.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 19 1 0 0 0 0 2 27 1 0 0 0 0 5 3 1 6 0 0 0 3 7 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 29 1 0 0 0 0 6 9 2 0 0 0 0 6 11 1 0 0 0 0 7 10 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 11 14 2 0 0 0 0 11 37 1 0 0 0 0 12 18 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 19 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 17 1 0 0 0 0 14 20 1 0 0 0 0 15 17 2 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 46 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 19 23 2 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 24 1 0 0 0 0 21 50 1 0 0 0 0 22 25 2 0 0 0 0 22 51 1 0 0 0 0 23 26 1 0 0 0 0 23 52 1 0 0 0 0 24 28 2 0 0 0 0 24 53 1 0 0 0 0 25 28 1 0 0 0 0 25 54 1 0 0 0 0 26 27 2 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 M CHG 1 3 1 M END > 52326283 > 1 > 477 > 2 > 1 > 8 > AAADceB7MAAAAAAAAAAAAAAAAAAAASAAAAAwYAAAAAAAAAAB0AAAHgAQAAAADCzhmAYyBIPABECIAqlSkACCCAAkIAAIiIGODMgOZjKEtTuXOSjk1hGYqYeYkcIOwAACAAAQAACAAAQAACAAAAAAAAAAAA== > [2-[benzyl(2-furylmethyl)amino]-2-oxo-ethyl]-[(1S)-1-(2,5-dimethylphenyl)ethyl]ammonium > [(1S)-1-(2,5-dimethylphenyl)ethyl]-[2-[2-furanylmethyl-(phenylmethyl)amino]-2-oxoethyl]ammonium > [2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-[(1S)-1-(2,5-dimethylphenyl)ethyl]azanium > [2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-[(1S)-1-(2,5-dimethylphenyl)ethyl]azanium > [(1S)-1-(2,5-dimethylphenyl)ethyl]-[2-[furan-2-ylmethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]azanium > [2-[benzyl(2-furfuryl)amino]-2-keto-ethyl]-[(1S)-1-(2,5-dimethylphenyl)ethyl]ammonium > InChI=1S/C24H28N2O2/c1-18-11-12-19(2)23(14-18)20(3)25-15-24(27)26(17-22-10-7-13-28-22)16-21-8-5-4-6-9-21/h4-14,20,25H,15-17H2,1-3H3/p+1/t20-/m0/s1 > FCLKQQJYSMBKRV-FQEVSTJZSA-O > 4 > 377.222903172 > C24H29N2O2+ > 377.5 > CC1=CC(=C(C=C1)C)C(C)[NH2+]CC(=O)N(CC2=CC=CC=C2)CC3=CC=CO3 > CC1=CC(=C(C=C1)C)[C@H](C)[NH2+]CC(=O)N(CC2=CC=CC=C2)CC3=CC=CO3 > 50.1 > 377.222903172 > 1 > 28 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 14 8 14 17 8 15 17 8 18 21 8 18 22 8 19 23 8 2 19 8 2 27 8 21 24 8 22 25 8 23 26 8 24 28 8 25 28 8 26 27 8 5 3 6 6 11 8 6 9 8 9 15 8 $$$$