Mol:FL7AAIGL0030
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
51 55 0 0 0 0 0 0 0 0999 V2000
-2.4872 1.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7398 1.4856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7398 2.3485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4872 2.7801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2344 2.3485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2344 1.4856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9925 1.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2452 1.4856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2452 2.3485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9925 2.7801 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0
0.4666 2.7595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1811 2.3471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8955 2.7595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8955 3.5845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1811 3.9969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4666 3.5845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6375 4.0128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8458 2.7015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4872 0.2456 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6410 1.0563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1993 4.6699 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7865 5.2570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6739 2.4075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3729 2.8112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9841 0.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0199 0.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9220 0.0751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4668 -0.7754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4310 -0.4747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5288 -0.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3620 1.1892 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5843 -0.0204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8458 -1.1932 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2790 -1.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2378 -2.0221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8447 -3.4908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6561 -4.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4816 -3.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4884 -3.8211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6772 -2.8288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8517 -3.4107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7083 -4.5255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3277 -4.8695 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1148 -3.7617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8356 -4.2068 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1736 -4.5634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3356 -4.2272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9070 -4.5238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1736 -5.2115 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5409 -4.1578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9070 -5.2570 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
2 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 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
14 17 1 0 0 0 0
5 18 1 0 0 0 0
1 19 1 0 0 0 0
8 20 1 0 0 0 0
15 21 1 0 0 0 0
21 22 1 0 0 0 0
13 23 1 0 0 0 0
23 24 1 0 0 0 0
25 26 1 0 0 0 0
26 27 1 1 0 0 0
28 27 1 1 0 0 0
29 28 1 1 0 0 0
29 30 1 0 0 0 0
30 25 1 0 0 0 0
20 26 1 0 0 0 0
25 31 1 0 0 0 0
30 32 1 0 0 0 0
29 33 1 0 0 0 0
28 34 1 0 0 0 0
34 35 1 0 0 0 0
36 37 1 0 0 0 0
37 38 1 1 0 0 0
39 38 1 1 0 0 0
40 39 1 1 0 0 0
40 41 1 0 0 0 0
41 36 1 0 0 0 0
35 40 1 0 0 0 0
39 42 1 0 0 0 0
38 43 1 0 0 0 0
36 44 1 0 0 0 0
37 45 1 0 0 0 0
46 47 1 0 0 0 0
47 48 1 0 0 0 0
46 49 2 0 0 0 0
48 50 1 0 0 0 0
48 51 2 0 0 0 0
45 46 1 0 0 0 0
M CHG 1 10 1
S SKP 5
ID FL7AAIGL0030
FORMULA C32H37O19
EXACTMASS 725.192904002
AVERAGEMASS 725.6247800000001
SMILES OC(C(O)1)C(OC(CC(O)=O)=O)C(OC1OCC(C(O)2)OC(Oc(c4c(c5)cc(OC)c(c(OC)5)O)cc(c([o+1]4)3)c(O)cc(c3)O)C(O)C(O)2)C
M END
