Mol:LBF16000PG02
Copyright: ARM project http://www.metabolome.jp/
23 23 0 0 0 0 0 0 0 0999 V2000 -1.1505 0.5295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 0.9420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6368 0.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6368 -0.4419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4241 -0.6977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9105 -0.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4241 0.6418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8051 -0.9420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0906 -0.5295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3763 -0.9420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3382 -0.5295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0526 -0.9420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7671 -0.5295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4816 -0.9420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -0.5294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6792 -1.4823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6791 1.4264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 0.9420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2784 0.5295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4361 1.7670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3764 -1.7670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9105 -0.9419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 0.2956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 3 2 1 6 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 3 1 0 4 8 1 1 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 5 16 1 6 7 17 1 6 1 18 1 0 18 19 1 0 18 20 2 0 10 21 2 0 15 22 1 0 15 23 2 0
S SKP 6 ID LBF16000PG02 FORMULA C16H26O7 EXACTMASS 330.167853186 AVERAGEMASS 330.37343999999996 SMILES OC(=O)CCCCC(=O)CC[C@@H]([C@H](O)1)[C@@H](CCC(O)=O)[C@@H](O)C1 AUTODRAW FALSE M END
