Mol:LBF28000BC01
Copyright: ARM project http://www.metabolome.jp/
33 32 0 0 0 0 0 0 0 0999 V2000 2.1433 0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8603 0.4162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5773 0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4262 0.4162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7093 0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0051 0.4147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2918 0.4147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0061 0.0022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2918 1.2398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7196 0.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 0.4147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1484 0.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8629 0.4146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5773 0.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2918 0.4145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0061 0.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0061 -0.8258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2893 -1.2398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5723 -0.8258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8553 -1.2398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1385 -0.8258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4216 -1.2398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7046 -0.8258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0098 -1.2383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7242 -0.8258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4387 -1.2383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7093 -0.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1433 -0.5396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5773 -0.5433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 -0.8257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8675 -1.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5819 -0.8256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2964 -1.2380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 1 4 1 0 4 5 1 0 5 6 1 0 3 7 1 0 7 8 1 0 7 9 2 0 6 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 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 5 27 1 0 1 28 1 0 3 29 1 0 26 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0
S SKP 6 ID LBF28000BC01 FORMULA C31H62O2 EXACTMASS 466.47498122800005 AVERAGEMASS 466.82278 SMILES C(CCCCCCC(CC(C)CC(C)C(O)=O)C)CCCCCCCCCCCCCCC AUTODRAW FALSE M END