Mrv0541 04131515152D 35 38 0 0 0 0 999 V2000 1.7602 -3.4741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4746 -3.0616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1891 -3.4741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1891 -4.2991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9036 -4.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6181 -4.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9036 -3.0615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7602 -4.2991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0457 -4.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3832 -4.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3832 -5.5366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3313 -5.9491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6181 -3.4740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3325 -3.0616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 -1.8241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0471 -0.9991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7615 -2.2367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4760 -1.8242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3326 -2.2366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9036 -2.2365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6181 -1.8240 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6181 -0.9990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9036 -0.5865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4746 -0.5865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4747 0.2386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1892 0.6510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9037 0.2385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6182 0.6510 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.1892 -0.9989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1891 -1.8240 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.3313 -4.2991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3313 -3.4741 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0457 -5.5366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7602 -5.9491 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.4747 -4.7115 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 1 2 1 0 0 0 0 8 35 1 0 0 0 0 35 4 2 0 0 0 0 3 2 2 0 0 0 0 3 7 1 0 0 0 0 4 3 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 13 1 0 0 0 0 13 7 2 0 0 0 0 8 9 1 0 0 0 0 33 9 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 31 2 0 0 0 0 11 12 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 14 19 1 0 0 0 0 19 15 1 0 0 0 0 15 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 19 21 1 0 0 0 0 21 20 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 27 23 2 0 0 0 0 23 29 1 0 0 0 0 27 26 1 0 0 0 0 29 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 M END > CHEBI:48477 > methyl N-(2,6-dichlorobenzyl)-3-[2-(2,6-dichlorophenyl)-6-quinolyl]-N-methylalaninate > A non-proteinogenic amino acid derivative that is the methyl ester of N-(2,6-dichlorobenzyl)-3-[2-(2,6-dichlorophenyl)-6-quinolyl]-N-methylalanine. > 3 > methyl 2-[(2,6-dichlorobenzyl)(methyl)amino]-3-[2-(2,6-dichlorophenyl)-6-quinolinyl]propanoate > methyl N-(2,6-dichlorobenzyl)-3-[2-(2,6-dichlorophenyl)quinolin-6-yl]-N-methylalaninate > C27H22Cl4N2O2 > 548.28800 > 546.04354 > 0 > COC(=O)C(Cc1ccc2nc(ccc2c1)-c1c(Cl)cccc1Cl)N(C)Cc1c(Cl)cccc1Cl > InChI=1S/C27H22Cl4N2O2/c1-33(15-18-19(28)5-3-6-20(18)29)25(27(34)35-2)14-16-9-11-23-17(13-16)10-12-24(32-23)26-21(30)7-4-8-22(26)31/h3-13,25H,14-15H2,1-2H3 > NSZLNWDQQOHFKP-UHFFFAOYSA-N $$$$