Mol:FL5FCGGS0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
44 48 0 0 0 0 0 0 0 0999 V2000
-2.7573 -1.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0429 -0.8558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0429 -0.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7573 0.3817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4718 -0.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4718 -0.8558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3283 -1.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6138 -0.8558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6138 -0.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3283 0.3817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1766 0.4256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8713 0.0244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5660 0.4256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5660 1.2278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8713 1.6288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1766 1.2278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2143 0.3980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7573 -1.9941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3283 -1.8890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8713 2.2890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1806 0.0707 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1956 1.5913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0733 -1.2525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0816 -2.3891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1999 -3.2660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5052 -2.7181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3720 -2.6006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4904 -1.7236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2045 -2.2716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6912 -2.8778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8396 -3.3155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7355 -3.5442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6332 -3.2318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5737 3.1741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1313 2.4077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9821 2.6509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8381 2.4265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2807 3.1929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4298 2.9498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9313 3.4743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9536 2.9531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5932 2.5567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0866 3.5442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.9536 0.3980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 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 2 0 0 0 0
6 1 1 0 0 0 0
2 7 1 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 3 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
5 17 1 0 0 0 0
1 18 1 0 0 0 0
7 19 2 0 0 0 0
15 20 1 0 0 0 0
13 21 1 0 0 0 0
14 22 1 0 0 0 0
8 23 1 0 0 0 0
24 25 1 0 0 0 0
25 26 1 1 0 0 0
27 26 1 1 0 0 0
28 27 1 1 0 0 0
28 29 1 0 0 0 0
29 24 1 0 0 0 0
23 28 1 0 0 0 0
24 30 1 0 0 0 0
25 31 1 0 0 0 0
26 32 1 0 0 0 0
27 33 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
22 35 1 0 0 0 0
39 40 1 0 0 0 0
38 41 1 0 0 0 0
37 42 1 0 0 0 0
36 43 1 0 0 0 0
17 44 1 0 0 0 0
S SKP 5
ID FL5FCGGS0002
FORMULA C28H32O16
EXACTMASS 624.1690349759999
AVERAGEMASS 624.54408
SMILES OC(C1O)C(C(OC(Oc(c5O)c(cc(c5)C(O3)=C(OC(O4)C(O)C(O)C(C(C)4)O)C(c(c32)c(cc(OC)c2)O)=O)O)1)C)O
M END
