Mol:LBG00ckk:YS2CA0001:CBZ1Sk013:18000SC01
34 34 0 0 0 0 0 0 0 0999 V2000 2.0233 3.3531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 2.4731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 1.6481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 1.6481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 2.4731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9795 1.6481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 2.4731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 2.4731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8545 3.1881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6809 3.1881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0948 2.4731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6809 1.7568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8545 1.7568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 1.6481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0955 0.9337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 0.2192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 0.2192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4455 -0.4953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6205 -0.4953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -1.2097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -1.2097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0295 -1.9242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8545 -1.9242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -2.6387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -2.6387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5045 -3.3531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3295 -3.3531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 -4.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5670 -4.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9795 -4.7821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8483 3.3531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2608 4.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8483 4.7821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0858 4.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 2 5 1 0 5 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 8 13 1 0 4 14 1 0 6 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 29 30 1 0 1 31 1 0 31 32 1 0 32 33 2 0 32 34 1 0
M STY 1 1 SUP M SLB 1 1 1 M SAL 1 15 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 M SAL 1 2 29 30 M SBL 1 2 13 14 M SMT 1 (CH2)17 M SBV 1 13 -0.8250 0.0000 M SBV 1 14 1.2966 0.0000 M STY 1 2 SUP M SLB 1 2 2 M SAL 2 4 31 32 33 34 M SBL 2 1 31 M SMT 2 OCOCH3 M SBV 2 31 -0.8250 0.0000 S SKP 5 ID LBG00ckk:YS2CA0001:CBZ1Sk013:18000SC01:01 FORMULA C30H52O4 EXACTMASS 476.38656015199996 AVERAGEMASS 476.73148 SMILES C(CCCCCCCCCCCC(OCC(COC(C)=O)OCc(c1)cccc1)C)CCCC M END
