Mol:LBF20406AM16
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
26 25 0 0 0 0 0 0 0 0999 V2000
-4.6665 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6665 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8415 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8415 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1279 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4143 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1279 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4143 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5893 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5893 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8756 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0790 -0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1620 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8756 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1620 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5516 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2652 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9788 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5516 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2652 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9793 -0.1121 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
1.2660 1.1261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9320 0.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6501 -0.1056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3609 0.3133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0790 -0.0928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 3 2 0 0 0 0
2 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 1 0 0 0 0
3 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
6 10 2 0 0 0 0
9 11 1 0 0 0 0
2 12 1 0 0 0 0
1 12 1 0 0 0 0
11 13 1 0 0 0 0
14 10 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
13 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
20 22 2 0 0 0 0
21 23 1 0 0 0 0
23 24 1 0 0 0 0
24 25 1 0 0 0 0
25 26 1 0 0 0 0
S SKP 5
ID LBF20406AM16
FORMULA C23H39NO2
EXACTMASS 361.298079497
AVERAGEMASS 361.5613
SMILES C(O)CCNC(=O)CCCC=CCC=CCC=CCC=CCCCCC
M END
