Mol:LBGPxc-p:16000SC01::p
31 30 0 0 0 0 0 0 0 0999 V2000 -0.4479 -5.1446 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.4479 -4.3198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4479 -5.9696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4935 -5.1446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1433 -5.1446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3185 -5.1446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1433 -3.6797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -3.2672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3184 -5.1446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3184 -5.9695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1433 -5.9695 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1433 -6.7945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1433 -2.3311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3184 -2.3311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3184 -1.5062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0328 -1.0937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -1.0937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0164 -0.3793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 0.0332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 0.7476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0001 1.1601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 1.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3019 2.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1106 3.0013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6038 3.4138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1914 4.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9058 4.5407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4933 5.2551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2077 5.6676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7953 6.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5097 6.7945 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 1 6 1 0 5 7 1 0 7 13 1 0 7 8 1 0 4 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0
M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 7 8 M SBL 1 2 6 7 M SMT 1 CHOH M SBV 1 6 0.0000 -1.4649 M SBV 1 7 0.0000 -1.4649 M STY 1 2 SUP M SLB 1 2 2 M SAL 2 4 9 10 11 12 M SBL 2 1 9 M SMT 2 CH2CH2NHCH3 M SBV 2 9 -0.8248 0.0000 M STY 1 3 SUP M SLB 1 3 3 M SAL 3 15 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 M SAL 3 4 28 29 30 31 M SBL 3 1 7 M SMT 3 CH2OCO(CH2)14CH3 M SBV 3 7 0.0000 -1.3485 S SKP 5 ID LBGPxc-p:16000SC01::ppppppppp:01 FORMULA C22H46NO7P EXACTMASS 467.30118934099994 AVERAGEMASS 467.576941 SMILES CCCCCCCCCCCCCCCC(=O)OCC(O)COP(O)(=O)OCCNC M END
