Mol:FL3FAADS0034
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
51 56 0 0 0 0 0 0 0 0999 V2000
2.1032 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3888 0.7136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6743 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6743 -0.5238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3888 -0.9363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1032 -0.5238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0401 0.7136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7546 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7546 -0.5238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0401 -0.9363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4256 0.6885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0401 -1.6758 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3888 -1.5084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5654 -0.1323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9818 -0.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2648 -0.3072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4396 -0.3210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0231 0.2626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7402 -0.1460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3222 0.2347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9202 0.0744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0379 -0.4052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5164 -0.7158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7201 -0.7241 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8849 0.7524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5994 0.3399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3139 0.7524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3139 1.5774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5994 1.9899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8849 1.5774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9290 1.9326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5145 1.0142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9310 0.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2140 0.8393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3890 0.8254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9724 1.4091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6894 1.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1113 1.3470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7386 1.3471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.9290 0.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.6619 0.4307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6670 0.5235 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.6874 -1.3983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1041 -1.9817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3874 -1.5732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5625 -1.5870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1459 -1.0035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8627 -1.4119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6874 -0.8306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.8244 -1.9818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9707 -1.9899 0.0000 O 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
14 15 1 1 0 0 0
15 16 1 1 0 0 0
17 16 1 1 0 0 0
17 18 1 0 0 0 0
18 19 1 0 0 0 0
19 14 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
14 22 1 0 0 0 0
15 23 1 0 0 0 0
16 24 1 0 0 0 0
9 17 1 0 0 0 0
1 25 1 0 0 0 0
25 26 2 0 0 0 0
26 27 1 0 0 0 0
27 28 2 0 0 0 0
28 29 1 0 0 0 0
29 30 2 0 0 0 0
30 25 1 0 0 0 0
28 31 1 0 0 0 0
32 33 1 1 0 0 0
33 34 1 1 0 0 0
35 34 1 1 0 0 0
35 36 1 0 0 0 0
36 37 1 0 0 0 0
37 32 1 0 0 0 0
37 38 1 0 0 0 0
38 39 1 0 0 0 0
32 40 1 0 0 0 0
33 41 1 0 0 0 0
34 42 1 0 0 0 0
35 11 1 0 0 0 0
43 44 1 1 0 0 0
44 45 1 1 0 0 0
46 45 1 1 0 0 0
46 47 1 0 0 0 0
47 48 1 0 0 0 0
48 43 1 0 0 0 0
43 49 1 0 0 0 0
44 50 1 0 0 0 0
45 51 1 0 0 0 0
46 24 1 0 0 0 0
S SKP 5
ID FL3FAADS0034
FORMULA C32H38O19
EXACTMASS 726.200729034
AVERAGEMASS 726.6327200000001
SMILES O(c(c(C(O6)C(C(O)C(O)C6CO)OC(O5)C(O)C(O)C(O)C5)4)cc(c(c4O)2)OC(c(c3)ccc(O)c3)=CC(=O)2)C(O1)C(C(O)C(O)C1CO)O
M END
