Mol:FL5FAAGL0011
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
42 46 0 0 0 0 0 0 0 0999 V2000
-3.4422 1.4020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4422 0.5925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7410 0.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0398 0.5925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0398 1.4020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7410 1.8068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3387 0.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6376 0.5925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6376 1.4020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3387 1.8068 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3387 -0.4435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0632 1.8066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7777 1.3941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4923 1.8066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4923 2.6318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7777 3.0443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0632 2.6318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7410 -0.6216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2581 -1.3737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7696 -2.2199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7091 -1.9513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6543 -2.2199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1429 -1.3737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2034 -1.6422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3507 -1.6168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3882 0.7747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8996 -0.0715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8392 0.1971 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7844 -0.0715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2730 0.7747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2936 0.5256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0603 0.1369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9485 1.0925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0013 0.4475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5798 0.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0129 -0.5673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1603 -2.0567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1378 -2.6891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6543 -3.0443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7279 0.5877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.1429 1.8066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2066 3.0441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 1 2 0 0 0 0
4 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 5 1 0 0 0 0
7 11 2 0 0 0 0
9 12 1 0 0 0 0
12 13 2 0 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 2 0 0 0 0
17 12 1 0 0 0 0
3 18 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 1 0 0 0
21 22 1 1 0 0 0
23 22 1 1 0 0 0
23 24 1 0 0 0 0
24 19 1 0 0 0 0
19 25 1 0 0 0 0
26 27 1 0 0 0 0
27 28 1 1 0 0 0
28 29 1 1 0 0 0
30 29 1 1 0 0 0
30 31 1 0 0 0 0
31 26 1 0 0 0 0
31 33 1 0 0 0 0
30 34 1 0 0 0 0
29 35 1 0 0 0 0
23 36 1 0 0 0 0
35 36 1 0 0 0 0
20 37 1 0 0 0 0
21 38 1 0 0 0 0
22 39 1 0 0 0 0
32 8 1 0 0 0 0
27 32 1 0 0 0 0
26 40 1 0 0 0 0
1 41 1 0 0 0 0
15 42 1 0 0 0 0
S SKP 5
ID FL5FAAGL0011
FORMULA C27H30O15
EXACTMASS 594.15847029
AVERAGEMASS 594.5181
SMILES c(O)(c1)cc(c(C(=O)2)c(OC(c(c5)ccc(c5)O)=C2OC(C4O)OC(C(C(O)4)O)COC(O3)C(C(O)C(O)C3C)O)1)O
M END
