Mol:FL5FACCS0002
From Metabolomics.JP
(Difference between revisions)
m (Mol:FL3FACCS0055 moved to Mol:FL5FACCS0002) |
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| Line 94: | Line 94: | ||
38 33 1 0 0 0 0 | 38 33 1 0 0 0 0 | ||
S SKP 5 | S SKP 5 | ||
| − | ID | + | ID FL5FACCS0002 |
FORMULA C27H30O16 | FORMULA C27H30O16 | ||
EXACTMASS 610.153384912 | EXACTMASS 610.153384912 | ||
Latest revision as of 12:34, 30 September 2009
Copyright: ARM project http://www.metabolome.jp/
43 47 0 0 0 0 0 0 0 0999 V2000
0.9391 -0.8523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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-0.4899 -0.8523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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2.4352 -0.8134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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-1.1519 1.0362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4152 0.2540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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-0.8541 1.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3841 1.6719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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-1.8644 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5985 1.9030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3131 2.3156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0863 1.5221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2956 0.7238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5810 0.3111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8077 1.1047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8464 0.6872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6662 1.9969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1189 2.7913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6373 2.5343 0.0000 C 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 2 0 0 0 0
4 5 1 0 0 0 0
5 6 1 0 0 0 0
6 1 2 0 0 0 0
3 7 1 0 0 0 0
7 8 2 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 4 1 0 0 0 0
8 11 1 0 0 0 0
10 12 1 0 0 0 0
5 13 2 0 0 0 0
1 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 18 1 0 0 0 0
18 19 2 0 0 0 0
19 14 1 0 0 0 0
17 20 1 0 0 0 0
6 21 1 0 0 0 0
16 22 1 0 0 0 0
23 24 1 1 0 0 0
24 25 1 1 0 0 0
26 25 1 1 0 0 0
26 27 1 0 0 0 0
27 28 1 0 0 0 0
28 23 1 0 0 0 0
28 29 1 0 0 0 0
29 30 1 0 0 0 0
23 31 1 0 0 0 0
24 32 1 0 0 0 0
25 33 1 0 0 0 0
7 26 1 0 0 0 0
34 35 1 0 0 0 0
35 36 1 1 0 0 0
37 36 1 1 0 0 0
38 37 1 1 0 0 0
38 39 1 0 0 0 0
39 34 1 0 0 0 0
37 40 1 0 0 0 0
36 41 1 0 0 0 0
35 42 1 0 0 0 0
34 43 1 0 0 0 0
38 33 1 0 0 0 0
S SKP 5
ID FL5FACCS0002
FORMULA C27H30O16
EXACTMASS 610.153384912
AVERAGEMASS 610.5175
SMILES C(O)C(O2)C(C(O)C(C2c(c(O)5)c(O3)c(c(c5)O)C(C(O)=C3c(c4)ccc(O)c(O)4)=O)OC(O1)C(O)C(O)C(C1C)O)O
M END
