Mol:FL5FACGS0102
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
54 59 0 0 0 0 0 0 0 0999 V2000
0.7691 1.5575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0546 1.9700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0546 2.7950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7691 3.2075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4836 2.7950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4836 1.9700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6598 1.5575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3743 1.9700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0888 1.5575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0888 0.7325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3743 0.3200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6598 0.7325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8032 1.9700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5177 1.5575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5177 0.7325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8032 0.3200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3743 -0.3408 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2322 1.9700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0609 0.2870 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8032 -0.4067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0755 3.1367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7691 3.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8419 -1.9995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0170 -2.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7752 -1.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1650 -0.6796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9900 -0.6547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2319 -1.4437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0846 -1.1654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9317 -2.6270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4612 -2.5349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7514 -1.4674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4133 -1.9358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0144 -2.3668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5838 -2.9641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7592 -2.9307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0327 -3.3221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4632 -2.7248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2877 -2.7581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.0900 -2.5603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.7495 -2.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6192 -3.3597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1128 -3.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5728 -1.7939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1764 -2.5162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3965 -1.7761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7930 -1.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6167 -1.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0445 -1.7415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8693 -1.7237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2663 -1.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8384 -0.2951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0136 -0.3129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0900 -0.9827 0.0000 O 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 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 7 2 0 0 0 0
9 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 10 1 0 0 0 0
14 18 1 0 0 0 0
11 17 2 0 0 0 0
12 19 1 0 0 0 0
16 20 1 0 0 0 0
5 21 1 0 0 0 0
4 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
25 29 1 0 0 0 0
23 30 1 0 0 0 0
24 31 1 0 0 0 0
28 32 1 0 0 0 0
32 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
35 40 1 0 0 0 0
34 41 1 0 0 0 0
36 42 1 0 0 0 0
37 43 1 0 0 0 0
33 38 1 0 0 0 0
26 19 1 0 0 0 0
44 45 2 0 0 0 0
44 46 1 0 0 0 0
46 47 2 0 0 0 0
47 48 1 0 0 0 0
48 49 2 0 0 0 0
49 50 1 0 0 0 0
50 51 2 0 0 0 0
51 52 1 0 0 0 0
52 53 2 0 0 0 0
53 48 1 0 0 0 0
51 54 1 0 0 0 0
29 44 1 0 0 0 0
S SKP 5
ID FL5FACGS0102
FORMULA C36H36O18
EXACTMASS 756.190164348
AVERAGEMASS 756.6602399999999
SMILES c(c6)(cc(O)c(c61)C(=O)C(OC(O4)C(C(C(C4COC(C(O)5)OC(C)C(O)C(O)5)O)O)OC(=O)C=Cc(c3)ccc(O)c3)=C(c(c2)ccc(O)c2O)O1)O
M END
