Mol:LBF18000HO15
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 21 20 0 0 1 0 0 0 0 0999 V2000 3.7850 0.1766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 -0.4064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9950 0.1766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5822 -0.3225 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0005 0.9438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 -0.4064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 0.1766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0359 -0.4064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 0.1766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -0.4064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 0.1766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -0.4064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9066 0.2591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6549 -0.5168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2383 0.0666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8216 -0.5168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 0.0666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2019 -0.1469 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7853 0.4364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5822 0.2229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4154 -0.9438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 2 0 0 0 0 1 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 18 21 1 4 0 0 0 S SKP 5 ID LBF18000HO15 FORMULA C18H36O3 EXACTMASS 300.266445018 AVERAGEMASS 300.47664 SMILES CCC(O)CCCCCCCCCCCCCCC(O)=O M END