Mol:LBGPxccp:08000SC01:08000SC01:p
28 27 0 0 0 0 0 0 0 0999 V2000 2.8925 -3.3034 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 2.8925 -2.4784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8925 -4.1283 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.8337 -3.3034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1969 -3.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1969 -1.8385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0219 -3.3034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1969 -0.4898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0218 -0.4898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0218 0.3351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3074 0.7476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7362 0.7476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3237 1.4620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0382 1.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6257 2.5889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3401 3.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9276 3.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6421 4.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3719 -1.8385 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3719 -1.0136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4531 -1.0136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8655 -1.7280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8655 -0.2991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9924 0.0028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7068 -0.4097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1193 0.3048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8337 -0.1077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 1 3 1 0 1 4 1 0 5 6 1 0 5 7 1 0 1 7 1 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 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 1 0 6 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 1 0 26 27 1 0 27 28 1 0
M CHG 1 3 -1 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 11 8 9 10 11 12 13 14 15 16 17 18 M SBL 1 1 7 M SMT 1 CH2OCO(CH2)6CH3 M SBV 1 7 0.0000 -1.3487 M STY 1 2 SUP M SLB 1 2 2 M SAL 2 10 19 20 21 22 23 24 25 26 27 28 M SBL 2 1 18 M SMT 2 ^OOC(CH2)6H3C M SBV 2 18 0.8250 0.0000 S SKP 5 ID LBGPxccp:08000SC01:08000SC01:ppppppppp:01 FORMULA C19H36O8P EXACTMASS 423.2147796379999 AVERAGEMASS 423.45810100000006 SMILES CCCCCCCC(=O)OCC(OOC(=C)CCCCCC)COP([O-1])(O)=O M END
