Mol:LBF19000BC01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 22 21 0 0 0 0 0 0 0 0999 V2000 -4.5073 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0902 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6732 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9243 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3413 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7582 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1752 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5923 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0093 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4263 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1568 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7398 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3241 -0.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9071 0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4901 -0.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0731 0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6562 -0.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2391 0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9568 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9596 -1.0340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6732 0.2090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0902 1.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 2 3 1 0 0 0 0 4 1 1 0 0 0 0 4 5 1 0 0 0 0 5 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 15 14 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 19 21 2 0 0 0 0 2 22 1 0 0 0 0 S SKP 5 ID LBF19000BC01 FORMULA C20H40O2 EXACTMASS 312.302830524 AVERAGEMASS 312.53040000000004 SMILES C(CCCCCCCCC(O)=O)CCCCCCCC(C)C M END