Mol:LBST03010057
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 29 31 0 0 0 0 0 0 0 0999 V2000 | + | 29 31 0 0 0 0 0 0 0 0999 V2000 |
| − | 9.4106 3.6606 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 9.4106 3.6606 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 9.4106 4.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.4106 4.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.5446 5.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.5446 5.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.6786 4.6606 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 7.6786 4.6606 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 7.6786 3.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.6786 3.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.5446 3.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.5446 3.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.6786 1.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.6786 1.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.5446 2.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.5446 2.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.8126 0.1606 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 6.8126 0.1606 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 7.6786 0.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.6786 0.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.8126 -0.8394 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 6.8126 -0.8394 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 7.6786 -1.3394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.6786 -1.3394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.5446 -0.8394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.5446 -0.8394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.5446 0.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.5446 0.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.8615 0.4696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.8615 0.4696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.2737 -0.3394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.2737 -0.3394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.8615 -1.1484 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 5.8615 -1.1484 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 4.2653 -3.2585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2653 -3.2585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5743 -2.3074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5743 -2.3074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.5525 -2.0995 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 5.5525 -2.0995 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 3.6473 -5.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6473 -5.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9781 -4.4174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9781 -4.4174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2872 -3.4664 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 3.2872 -3.4664 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 6.8126 -1.8394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.8126 -1.8394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -4.6253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -4.6253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.2216 -2.8426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.2216 -2.8426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6180 -2.7232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6180 -2.7232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 10.4106 3.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 10.4106 3.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.8126 5.1606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.8126 5.1606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 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 |
| − | 1 6 1 0 0 0 0 | + | 1 6 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 6 8 2 0 0 0 0 | + | 6 8 2 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 7 10 2 0 0 0 0 | + | 7 10 2 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 0 0 0 |
| − | 11 12 1 6 0 0 0 | + | 11 12 1 6 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 10 14 1 0 0 0 0 | + | 10 14 1 0 0 0 0 |
| − | 9 15 1 1 0 0 0 | + | 9 15 1 1 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 17 16 1 1 0 0 0 | + | 17 16 1 1 0 0 0 |
| − | 11 17 1 0 0 0 0 | + | 11 17 1 0 0 0 0 |
| − | 18 19 2 0 0 0 0 | + | 18 19 2 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 18 23 1 0 0 0 0 | + | 18 23 1 0 0 0 0 |
| − | 17 20 1 0 0 0 0 | + | 17 20 1 0 0 0 0 |
| − | 11 24 1 1 0 0 0 | + | 11 24 1 1 0 0 0 |
| − | 22 25 1 0 0 0 0 | + | 22 25 1 0 0 0 0 |
| − | 20 26 1 6 0 0 0 | + | 20 26 1 6 0 0 0 |
| − | 23 27 1 1 0 0 0 | + | 23 27 1 1 0 0 0 |
| − | 1 28 1 6 0 0 0 | + | 1 28 1 6 0 0 0 |
| − | 4 29 1 6 0 0 0 | + | 4 29 1 6 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBST03010057 | + | ID LBST03010057 |
| − | FORMULA C28H46O | + | FORMULA C28H46O |
| − | EXACTMASS 398.354866094 | + | EXACTMASS 398.354866094 |
| − | AVERAGEMASS 398.66424 | + | AVERAGEMASS 398.66424 |
| − | SMILES C[C@@H](C1)C(=CC=C(C3)[C@H](C2)[C@@](CC3)(C)[C@H](C2)[C@H](C)C=C[C@@H](C(C)C)C)C[C@@H](C1)O | + | SMILES C[C@@H](C1)C(=CC=C(C3)[C@H](C2)[C@@](CC3)(C)[C@H](C2)[C@H](C)C=C[C@@H](C(C)C)C)C[C@@H](C1)O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
29 31 0 0 0 0 0 0 0 0999 V2000
9.4106 3.6606 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
9.4106 4.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5446 5.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6786 4.6606 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
7.6786 3.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5446 3.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6786 1.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5446 2.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8126 0.1606 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
7.6786 0.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8126 -0.8394 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
7.6786 -1.3394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5446 -0.8394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5446 0.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8615 0.4696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2737 -0.3394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8615 -1.1484 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.2653 -3.2585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5743 -2.3074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5525 -2.0995 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.6473 -5.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9781 -4.4174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2872 -3.4664 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.8126 -1.8394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -4.6253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2216 -2.8426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6180 -2.7232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.4106 3.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8126 5.1606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 5 1 0 0 0 0
5 6 1 0 0 0 0
1 6 1 0 0 0 0
7 8 1 0 0 0 0
6 8 2 0 0 0 0
9 10 1 0 0 0 0
7 10 2 0 0 0 0
9 11 1 0 0 0 0
11 12 1 6 0 0 0
12 13 1 0 0 0 0
13 14 1 0 0 0 0
10 14 1 0 0 0 0
9 15 1 1 0 0 0
15 16 1 0 0 0 0
17 16 1 1 0 0 0
11 17 1 0 0 0 0
18 19 2 0 0 0 0
19 20 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 0 0 0 0
18 23 1 0 0 0 0
17 20 1 0 0 0 0
11 24 1 1 0 0 0
22 25 1 0 0 0 0
20 26 1 6 0 0 0
23 27 1 1 0 0 0
1 28 1 6 0 0 0
4 29 1 6 0 0 0
S SKP 5
ID LBST03010057
FORMULA C28H46O
EXACTMASS 398.354866094
AVERAGEMASS 398.66424
SMILES C[C@@H](C1)C(=CC=C(C3)[C@H](C2)[C@@](CC3)(C)[C@H](C2)[C@H](C)C=C[C@@H](C(C)C)C)C[C@@H](C1)O
M END
