Mol:LBF20806AM02
From Metabolomics.JP
(Difference between revisions)
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 31 31 0 0 0 0 0 0 0 0999 V2000 | + | 31 31 0 0 0 0 0 0 0 0999 V2000 |
| − | -5.4182 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.4182 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.4182 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.4182 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.5932 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.5932 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.5932 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.5932 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8796 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8796 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1660 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1660 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3410 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3410 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.8307 -0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.8307 -0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6273 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6273 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9137 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9137 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8796 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8796 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1660 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1660 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2001 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2001 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5135 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5135 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2271 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2271 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3410 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3410 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6273 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6273 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9137 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9137 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2001 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2001 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5135 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5135 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1807 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1807 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5932 -0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5932 -0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4182 -0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4182 -0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.8307 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.8307 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4182 1.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4182 1.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5932 1.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5932 1.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2276 -0.1121 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2276 -0.1121 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5143 1.1261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5143 1.1261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9421 0.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9421 0.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6566 -0.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6566 -0.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3710 0.3004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3710 0.3004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 3 2 0 0 0 0 | + | 1 3 2 0 0 0 0 |
| − | 2 4 2 0 0 0 0 | + | 2 4 2 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 7 2 0 0 0 0 | + | 6 7 2 0 0 0 0 |
| − | 2 8 1 0 0 0 0 | + | 2 8 1 0 0 0 0 |
| − | 1 8 1 0 0 0 0 | + | 1 8 1 0 0 0 0 |
| − | 9 7 1 0 0 0 0 | + | 9 7 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 3 11 1 0 0 0 0 | + | 3 11 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 13 10 1 0 0 0 0 | + | 13 10 1 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
| − | 12 16 2 0 0 0 0 | + | 12 16 2 0 0 0 0 |
| − | 16 17 1 0 0 0 0 | + | 16 17 1 0 0 0 0 |
| − | 17 18 1 0 0 0 0 | + | 17 18 1 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 21 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 23 24 2 0 0 0 0 | + | 23 24 2 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 25 26 2 0 0 0 0 | + | 25 26 2 0 0 0 0 |
| − | 21 26 1 0 0 0 0 | + | 21 26 1 0 0 0 0 |
| − | 20 27 1 0 0 0 0 | + | 20 27 1 0 0 0 0 |
| − | 20 28 2 0 0 0 0 | + | 20 28 2 0 0 0 0 |
| − | 27 29 1 0 0 0 0 | + | 27 29 1 0 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | 30 31 1 0 0 0 0 | + | 30 31 1 0 0 0 0 |
| − | 31 21 1 0 0 0 0 | + | 31 21 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF20806AM02 | + | ID LBF20806AM02 |
| − | FORMULA C28H41NO2 | + | FORMULA C28H41NO2 |
| − | EXACTMASS 423.313729561 | + | EXACTMASS 423.313729561 |
| − | AVERAGEMASS 423.63068 | + | AVERAGEMASS 423.63068 |
| − | SMILES C(=CCCCC(NCCOc(c1)cccc1)=O)CC=CCC=CCC=CCCCCC | + | SMILES C(=CCCCC(NCCOc(c1)cccc1)=O)CC=CCC=CCC=CCCCCC |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
31 31 0 0 0 0 0 0 0 0999 V2000
-5.4182 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.4182 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5932 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5932 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8796 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1660 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3410 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8307 -0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6273 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9137 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8796 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1660 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2001 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5135 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2271 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3410 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6273 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9137 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2001 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5135 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1807 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5932 -0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4182 -0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8307 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4182 1.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5932 1.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2276 -0.1121 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
0.5143 1.1261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9421 0.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6566 -0.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3710 0.3004 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
6 7 2 0 0 0 0
2 8 1 0 0 0 0
1 8 1 0 0 0 0
9 7 1 0 0 0 0
9 10 1 0 0 0 0
3 11 1 0 0 0 0
11 12 1 0 0 0 0
13 10 1 0 0 0 0
13 14 1 0 0 0 0
14 15 1 0 0 0 0
12 16 2 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
21 22 2 0 0 0 0
22 23 1 0 0 0 0
23 24 2 0 0 0 0
24 25 1 0 0 0 0
25 26 2 0 0 0 0
21 26 1 0 0 0 0
20 27 1 0 0 0 0
20 28 2 0 0 0 0
27 29 1 0 0 0 0
29 30 1 0 0 0 0
30 31 1 0 0 0 0
31 21 1 0 0 0 0
S SKP 5
ID LBF20806AM02
FORMULA C28H41NO2
EXACTMASS 423.313729561
AVERAGEMASS 423.63068
SMILES C(=CCCCC(NCCOc(c1)cccc1)=O)CC=CCC=CCC=CCCCCC
M END
