Mol:LBGMG-c-::18109SC01 2
25 24 0 0 0 0 0 0 0 0999 V2000 -6.8809 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2168 -0.3836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5526 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8872 -0.3836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2231 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5589 -0.3836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8948 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 -0.3836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5651 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7979 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1337 -0.3836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5303 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1944 -0.3836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8586 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5241 -0.3836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1869 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 -0.3836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5164 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5164 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3414 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1664 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1664 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8809 1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1664 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4520 -1.2375 0.0000 O 0 0 0 0 0 0 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 2 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 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 21 24 1 0 24 25 1 0
M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 22 23 M SBL 1 1 21 M SMT 1 CH2OH M SBV 1 21 0.0000 -0.8250 M STY 1 2 SUP M SLB 1 2 2 M SAL 2 2 24 25 M SBL 2 1 23 M SMT 2 CH2OH M SBV 2 23 0.0000 0.8250 S SKP 5 ID LBGMG-c-::18109SC01::02 FORMULA C21H40O4 EXACTMASS 356.29265976799996 AVERAGEMASS 356.53989999999993 SMILES CCCCCCCCC=CCCCCCCCC(=O)OC(CO)CO M END
