Mol:LBGPxc-p:18000SC01::OPP--0002
29 28 0 0 0 0 0 0 0 0999 V2000 -0.2818 -6.1205 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.2818 -5.2956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2818 -6.9455 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6594 -6.1205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9775 -6.1205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1525 -6.1205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9775 -4.6555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 -4.2431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9775 -3.3070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1525 -3.3070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1525 -2.4821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8669 -2.0696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4381 -2.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8506 -1.3552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1362 -0.9427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5486 -0.2283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1658 0.1842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2467 0.8986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4677 1.3111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0553 2.0255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7697 2.4379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 3.1524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0716 3.5648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6592 4.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3736 4.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9611 5.4061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6755 5.8186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 6.5330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9775 6.9455 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 9 1 0 7 8 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 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
M CHG 1 3 -1 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 15 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 M SAL 2 6 24 25 26 27 28 29 M SBL 2 1 7 M SMT 2 CH2OCO(CH2)16CH3 M SBV 2 7 -0.0000 -1.3485 S SKP 5 ID LBGPxc-p:18000SC01::OPP--0002:01 FORMULA C21H42O7P EXACTMASS 437.26681520799997 AVERAGEMASS 437.52774100000005 SMILES CCCCCCCCCCCCCCCCCC(=O)OCC(O)COP([O-1])(O)=O M END