Mol:LBF20406LT04
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 26 25 0 0 0 0 0 0 0 0999 V2000 | + | 26 25 0 0 0 0 0 0 0 0999 V2000 |
| − | 5.4641 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 -3.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 4.5981 -3.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.1962 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.1962 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.0622 1.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 8.0622 1.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 8.0622 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0622 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.9282 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.9282 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.9282 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.9282 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.7942 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.7942 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.7942 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.7942 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 10.6603 6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 10.6603 6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 10.6603 7.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 10.6603 7.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 11.5263 7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 11.5263 7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -7.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -7.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.9282 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.9282 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -5.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -5.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
| − | 3 2 1 0 0 0 0 | + | 3 2 1 0 0 0 0 |
| − | 4 3 1 0 0 0 0 | + | 4 3 1 0 0 0 0 |
| − | 5 4 1 0 0 0 0 | + | 5 4 1 0 0 0 0 |
| − | 6 5 1 0 0 0 0 | + | 6 5 1 0 0 0 0 |
| − | 2 24 1 6 0 0 0 | + | 2 24 1 6 0 0 0 |
| − | 1 7 2 0 0 0 0 | + | 1 7 2 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 11 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
| − | 12 25 1 1 0 0 0 | + | 12 25 1 1 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 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 |
| − | 6 21 1 0 0 0 0 | + | 6 21 1 0 0 0 0 |
| − | 6 26 2 0 0 0 0 | + | 6 26 2 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 21 23 1 0 0 0 0 | + | 21 23 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF20406LT04 | + | ID LBF20406LT04 |
| − | FORMULA C22H37NO3 | + | FORMULA C22H37NO3 |
| − | EXACTMASS 363.27734405499996 | + | EXACTMASS 363.27734405499996 |
| − | AVERAGEMASS 363.53412000000003 | + | AVERAGEMASS 363.53412000000003 |
| − | SMILES C(=CC[C@@H](O)C=CC=CC=C[C@H](CCCC(N(C)C)=O)O)CCCCC | + | SMILES C(=CC[C@@H](O)C=CC=CC=C[C@H](CCCC(N(C)C)=O)O)CCCCC |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
26 25 0 0 0 0 0 0 0 0999 V2000
5.4641 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.5981 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 1.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
8.0622 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 7.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -7.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -5.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 1 1 0 0 0 0
3 2 1 0 0 0 0
4 3 1 0 0 0 0
5 4 1 0 0 0 0
6 5 1 0 0 0 0
2 24 1 6 0 0 0
1 7 2 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 11 2 0 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
12 25 1 1 0 0 0
13 14 1 0 0 0 0
14 15 2 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
6 21 1 0 0 0 0
6 26 2 0 0 0 0
21 22 1 0 0 0 0
21 23 1 0 0 0 0
S SKP 5
ID LBF20406LT04
FORMULA C22H37NO3
EXACTMASS 363.27734405499996
AVERAGEMASS 363.53412000000003
SMILES C(=CC[C@@H](O)C=CC=CC=C[C@H](CCCC(N(C)C)=O)O)CCCCC
M END
