Source: Brenda (C. Rea)^Converter: smi2mol (Daylight 4.6) SMI2MOL CC(C)C[C@@H](NC(=O)c1ccccc1)C(=O)O 18 18 0 0 0 0 1 V2000 3.5200 2.8400 0.0000 C 0 0 0 0 0 0 2.8000 3.5700 0.0000 C 0 0 0 0 0 0 3.0600 4.5500 0.0000 C 0 0 0 0 0 0 1.8200 3.3100 0.0000 C 0 0 0 0 0 0 0.8400 3.0500 0.0000 C 0 0 1 0 0 0 -0.1400 2.7800 0.0000 N 0 0 0 0 0 0 -1.1200 2.5100 0.0000 C 0 0 0 0 0 0 -1.3800 1.5300 0.0000 O 0 0 0 0 0 0 -1.8400 3.2300 0.0000 C 0 0 0 0 0 0 -1.5500 4.1800 0.0000 C 0 0 0 0 0 0 -2.2700 4.9000 0.0000 C 0 0 0 0 0 0 -3.2500 4.6400 0.0000 C 0 0 0 0 0 0 -3.5200 3.6700 0.0000 C 0 0 0 0 0 0 -2.8100 2.9600 0.0000 C 0 0 0 0 0 0 0.5800 4.0300 0.0000 C 0 0 0 0 0 0 1.3000 4.7500 0.0000 O 0 0 0 0 0 0 -0.4000 4.2900 0.0000 O 0 0 0 0 0 0 1.1050 2.0700 0.0000 H 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 5 4 1 1 5 6 1 1 6 7 1 0 7 8 2 0 7 9 1 0 9 14 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 5 15 1 6 15 16 2 0 15 17 1 0 5 18 1 6 M END