Mol:LBF18106HO02
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 22 21 0 0 1 0 0 0 0 0999 V2000 -4.3553 1.7745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2106 1.7745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5315 1.7745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5948 1.7745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5464 1.7745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5464 2.5123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5948 2.5123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7733 1.7745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3609 1.0601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5358 1.0601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1233 0.3456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4398 1.7745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8523 1.0601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4398 0.3456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8523 -0.3689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4398 -1.0834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8523 -1.7978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4398 -2.5123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9428 1.7745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3553 2.4891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3553 1.0601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2106 1.7745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 4 0 0 0 4 7 1 4 0 0 0 1 8 1 0 0 0 0 2 11 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 5 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 18 17 1 4 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 2 22 2 0 0 0 0 S SKP 5 ID LBF18106HO02 FORMULA C18H34O4 EXACTMASS 314.24570957599997 AVERAGEMASS 314.46016 SMILES CCCCCC=CCC(O)C(O)CCCCCCCC(O)=O M END