Source: Brenda (C. Rea)^Converter: smi2mol (Daylight 4.6) SMI2MOL CCCCCCCCCCCCCCCCC(=O)OCC(=O)COP(=O)(O)O 28 27 0 0 0 0 1 V2000 10.8800 1.5300 0.0000 C 0 0 0 0 0 0 9.9000 1.7900 0.0000 C 0 0 0 0 0 0 8.9200 2.0500 0.0000 C 0 0 0 0 0 0 7.9400 2.3100 0.0000 C 0 0 0 0 0 0 6.9600 2.5700 0.0000 C 0 0 0 0 0 0 5.9800 2.8300 0.0000 C 0 0 0 0 0 0 5.0000 3.0900 0.0000 C 0 0 0 0 0 0 4.0200 3.3500 0.0000 C 0 0 0 0 0 0 3.0400 3.6100 0.0000 C 0 0 0 0 0 0 2.0600 3.8700 0.0000 C 0 0 0 0 0 0 1.0800 4.1300 0.0000 C 0 0 0 0 0 0 0.1000 4.4000 0.0000 C 0 0 0 0 0 0 -0.8800 4.6700 0.0000 C 0 0 0 0 0 0 -1.8600 4.9400 0.0000 C 0 0 0 0 0 0 -2.8400 5.2100 0.0000 C 0 0 0 0 0 0 -3.8200 5.4800 0.0000 C 0 0 0 0 0 0 -4.8000 5.7500 0.0000 C 0 0 0 0 0 0 -5.0700 6.7300 0.0000 O 0 0 0 0 0 0 -5.5200 5.0300 0.0000 O 0 0 0 0 0 0 -6.2400 4.3100 0.0000 C 0 0 0 0 0 0 -6.9600 3.5900 0.0000 C 0 0 0 0 0 0 -6.7000 2.6100 0.0000 O 0 0 0 0 0 0 -7.9400 3.8500 0.0000 C 0 0 0 0 0 0 -8.9200 4.1100 0.0000 O 0 0 0 0 0 0 -9.9000 4.3700 0.0000 P 0 0 0 0 0 0 -10.1600 3.3900 0.0000 O 0 0 0 0 0 0 -9.6300 5.3500 0.0000 O 0 0 0 0 0 0 -10.8800 4.6300 0.0000 O 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 25 28 1 0 M END