Mol:FL5FAAGL0082
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
53 58 0 0 0 0 0 0 0 0999 V2000
-4.2267 1.4521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2267 0.6271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5123 0.2147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7979 0.6271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7979 1.4521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5123 1.8646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0834 0.2147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3690 0.6271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3690 1.4521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0834 1.8646 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0834 -0.4285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4694 2.0233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2586 1.6030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9868 2.0233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9868 2.8641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2586 3.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4694 2.8641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5123 -0.6100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7661 3.3141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.8889 2.0349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5607 0.1605 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0905 -0.8487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8009 -0.4385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5755 -1.2273 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8009 -2.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0905 -2.4313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3158 -1.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1075 -0.0676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2747 -3.0580 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6896 -2.6954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5308 -2.9246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8562 -3.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0703 -2.5652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8562 -1.8118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5308 -1.4223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3169 -2.1712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2641 -0.9933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9167 -1.2654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9222 -1.7626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1390 -2.9151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2140 -3.1419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2656 -2.1362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6172 0.3640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6162 1.0872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2000 -0.1128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1005 0.2315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7366 -0.1357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7366 -0.9643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4541 -1.3786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1718 -0.9643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1718 -0.1357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4541 0.2785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8889 -1.3783 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
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 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
7 11 2 0 0 0 0
9 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 12 1 0 0 0 0
3 18 1 0 0 0 0
19 15 1 0 0 0 0
4 3 1 0 0 0 0
1 20 1 0 0 0 0
21 8 1 0 0 0 0
22 23 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 22 1 0 0 0 0
22 28 1 0 0 0 0
26 29 1 0 0 0 0
25 30 1 0 0 0 0
23 21 1 0 0 0 0
32 31 1 1 0 0 0
32 33 1 0 0 0 0
33 34 1 0 0 0 0
34 35 1 0 0 0 0
35 36 1 1 0 0 0
36 31 1 1 0 0 0
35 37 1 0 0 0 0
34 38 1 0 0 0 0
36 39 1 0 0 0 0
31 40 1 0 0 0 0
32 41 1 0 0 0 0
41 30 1 0 0 0 0
27 42 1 0 0 0 0
28 43 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
S SKP 5
ID FL5FAAGL0082
FORMULA C36H36O17
EXACTMASS 740.1952497259999
AVERAGEMASS 740.66084
SMILES C(C)(O1)C(O)C(O)C(C1OCC(O2)C(C(O)C(OC(C=Cc(c6)ccc(O)c6)=O)C2OC(C5=O)=C(Oc(c45)cc(cc(O)4)O)c(c3)ccc(c3)O)O)O
M END
