Mol:FL2FA9GM0003
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
38 42 0 0 0 0 0 0 0 0999 V2000
0.7925 0.1544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5051 0.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7956 -0.6706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5124 -1.0800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2250 -0.6643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2214 0.1607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9413 -1.0736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6540 -0.6580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6503 0.1670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9340 0.5764 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3041 0.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0201 0.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7330 0.5534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7298 1.3784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0138 1.7881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3009 1.3728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9424 -1.7169 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1302 0.3654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5124 -1.7881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0985 -1.0731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3413 0.6036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9287 -0.1111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1303 0.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3369 -0.1288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7494 0.5860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5478 0.3769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6619 -0.3703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5923 -0.1708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9391 0.2584 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.0473 -0.0234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6347 -0.7381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8363 -0.5289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0429 -0.7558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4554 -0.0410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2538 -0.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3095 -1.0557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.2025 -0.5859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.7330 -0.4192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
1 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 2 1 0 0 0 0
5 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 6 1 0 0 0 0
9 11 1 0 0 0 0
11 12 2 0 0 0 0
12 13 1 0 0 0 0
13 14 2 0 0 0 0
14 15 1 0 0 0 0
15 16 2 0 0 0 0
16 11 1 0 0 0 0
7 17 2 0 0 0 0
1 18 1 0 0 0 0
4 19 1 0 0 0 0
3 20 1 0 0 0 0
21 22 1 1 0 0 0
22 23 1 1 0 0 0
24 23 1 1 0 0 0
24 25 1 0 0 0 0
25 26 1 0 0 0 0
26 21 1 0 0 0 0
23 27 1 0 0 0 0
22 28 1 0 0 0 0
21 29 1 0 0 0 0
30 31 1 1 0 0 0
31 32 1 1 0 0 0
33 32 1 1 0 0 0
33 34 1 0 0 0 0
34 35 1 0 0 0 0
35 30 1 0 0 0 0
32 36 1 0 0 0 0
31 37 1 0 0 0 0
30 38 1 0 0 0 0
24 18 1 0 0 0 0
33 28 1 0 0 0 0
S SKP 5
ID FL2FA9GM0003
FORMULA C26H30O12
EXACTMASS 534.173726424
AVERAGEMASS 534.5092
SMILES C(C1O)(OC(C5O)OCC(C5O)O)C(O)COC(Oc(c(C)4)cc(c3c4O)OC(CC3=O)c(c2)cccc2)1
M END
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