Mol:FL5FAAGS0137
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
74 81 0 0 0 0 0 0 0 0999 V2000
3.8792 4.0051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8792 3.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5223 2.8913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1652 3.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1652 4.0051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5223 4.3763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2362 2.8913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5933 3.2626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9502 2.8913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9502 2.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5933 1.7776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2362 2.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3072 3.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6642 2.8913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6642 2.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3072 1.7776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5933 1.1312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0212 3.2626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8461 1.7576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.7059 4.3172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3072 1.1480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0671 -0.3024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8824 -0.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2210 0.3224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8959 0.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0806 0.9252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7419 0.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0676 0.2685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3662 -0.3242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9110 -0.8316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4706 -0.8781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1312 0.3853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1640 -1.1301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5766 -1.8448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2169 -1.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0151 -1.8273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4278 -1.1126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6343 -1.3393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0105 -2.4220 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4243 -2.3023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1633 -1.5812 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7954 -1.1717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6258 -0.8930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2550 -0.2508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3672 -0.8930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7380 -1.5351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4795 -1.5351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8507 -0.8921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5932 -0.8921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9644 -1.5351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5932 -2.1781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8507 -2.1781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7059 -1.5351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7138 -3.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9287 -4.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4762 -3.3391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7350 -2.9760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5202 -2.7217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9728 -3.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5849 -3.3089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0429 -3.7148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0363 -4.3763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4959 -4.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7403 -3.4356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3398 -0.9638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4254 -1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9346 -1.1351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7037 -0.8359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6183 -0.0150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1089 -0.6644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0996 -1.3480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9395 -2.0065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9290 -1.9018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9406 -1.4559 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 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
5 20 1 0 0 0 0
16 21 1 0 0 0 0
22 23 1 1 0 0 0
23 24 1 1 0 0 0
25 24 1 1 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 22 1 0 0 0 0
27 28 1 0 0 0 0
28 29 1 0 0 0 0
22 30 1 0 0 0 0
23 31 1 0 0 0 0
24 32 1 0 0 0 0
25 19 1 0 0 0 0
33 34 1 0 0 0 0
34 35 1 1 0 0 0
36 35 1 1 0 0 0
37 36 1 1 0 0 0
37 38 1 0 0 0 0
38 33 1 0 0 0 0
36 39 1 0 0 0 0
35 40 1 0 0 0 0
34 41 1 0 0 0 0
33 42 1 0 0 0 0
37 29 1 0 0 0 0
43 44 2 0 0 0 0
43 45 1 0 0 0 0
45 46 2 0 0 0 0
46 47 1 0 0 0 0
47 48 2 0 0 0 0
48 49 1 0 0 0 0
49 50 2 0 0 0 0
50 51 1 0 0 0 0
51 52 2 0 0 0 0
52 47 1 0 0 0 0
50 53 1 0 0 0 0
41 43 1 0 0 0 0
54 55 1 1 0 0 0
55 56 1 1 0 0 0
57 56 1 1 0 0 0
57 58 1 0 0 0 0
58 59 1 0 0 0 0
59 54 1 0 0 0 0
59 60 1 0 0 0 0
60 61 1 0 0 0 0
54 62 1 0 0 0 0
55 63 1 0 0 0 0
56 64 1 0 0 0 0
57 40 1 0 0 0 0
65 66 1 0 0 0 0
66 67 1 1 0 0 0
68 67 1 1 0 0 0
69 68 1 1 0 0 0
69 70 1 0 0 0 0
70 65 1 0 0 0 0
68 71 1 0 0 0 0
67 72 1 0 0 0 0
66 73 1 0 0 0 0
65 74 1 0 0 0 0
69 32 1 0 0 0 0
S SKP 5
ID FL5FAAGS0137
FORMULA C48H56O26
EXACTMASS 1048.305981964
AVERAGEMASS 1048.94264
SMILES C(C(OC(C7OC(O8)C(O)C(C(C(C)8)O)O)OC(C(C(O)7)O)COC(C5O)OC(C)C(C5OC(O6)C(O)C(C(O)C6CO)O)OC(C=Cc(c4)ccc(O)c4)=O)=2)(c(c1OC2c(c3)ccc(O)c3)c(O)cc(O)c1)=O
M END
