Mol:FL7AACGL0015
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
51 56 0 0 0 0 0 0 0 0999 V2000
-3.6060 1.7898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6060 0.9803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9050 0.5756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2040 0.9803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2040 1.7898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9050 2.1946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5030 0.5756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8020 0.9803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8020 1.7898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5030 2.1946 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0
-0.1012 2.1943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6132 1.7819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3277 2.1943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3277 3.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6132 3.4319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1012 3.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9050 -0.2336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6132 4.2566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0731 0.4345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7522 -0.7184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0939 -0.2299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1746 -1.1693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0939 -2.1144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7522 -2.6029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4838 -1.6635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6136 -0.1013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1537 -2.0502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5139 -3.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1683 -2.9307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3068 2.1943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4216 0.4744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0336 -0.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7855 0.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6510 0.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0391 0.9030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2870 0.4744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3530 -0.1503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3068 0.7109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5605 -0.1803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0420 3.4317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4780 -3.3921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0415 -2.2380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0630 -2.2380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3289 -2.9482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0778 -3.9444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0563 -3.9445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7904 -3.2340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3922 -2.6815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1111 -1.4236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4806 -1.7989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8870 -4.2566 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 2 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 5 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
3 17 1 0 0 0 0
15 18 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 1 0 0 0
22 23 1 1 0 0 0
24 23 1 1 0 0 0
24 25 1 0 0 0 0
25 20 1 0 0 0 0
20 26 1 0 0 0 0
25 27 1 0 0 0 0
24 28 1 0 0 0 0
23 29 1 0 0 0 0
21 19 1 0 0 0 0
19 8 1 0 0 0 0
1 30 1 0 0 0 0
31 32 1 1 0 0 0
32 33 1 1 0 0 0
34 33 1 1 0 0 0
34 35 1 0 0 0 0
35 36 1 0 0 0 0
36 31 1 0 0 0 0
32 37 1 0 0 0 0
34 38 1 0 0 0 0
33 39 1 0 0 0 0
31 26 1 0 0 0 0
14 40 1 0 0 0 0
42 43 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 42 1 0 0 0 0
46 41 1 0 0 0 0
44 48 1 0 0 0 0
43 49 1 0 0 0 0
42 50 1 0 0 0 0
45 51 1 0 0 0 0
41 29 1 0 0 0 0
M CHG 1 10 1
S SKP 5
ID FL7AACGL0015
FORMULA C32H39O19
EXACTMASS 727.208554066
AVERAGEMASS 727.64066
SMILES C(C(O)4)(C(OC(O6)C(C(C(C6)O)O)O)C(OC4COC(O5)C(O)C(O)C(C5C)O)Oc(c3)c([o+1]c(c32)cc(cc2O)O)c(c1)cc(O)c(c1)O)O
M END
