Mol:FL5FFAGS0004
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
31 34 0 0 0 0 0 0 0 0999 V2000
-2.1681 -0.9209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1681 -1.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4536 -2.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7392 -1.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7392 -0.9209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4536 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0247 -2.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6897 -1.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6897 -0.9209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0247 -0.5084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0247 -2.8016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4039 -0.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1321 -0.9290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8602 -0.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8602 0.3323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1321 0.7527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4039 0.3323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8823 -0.5085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4127 -2.1389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4536 -2.9831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4822 0.8678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8855 2.7062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2509 1.8390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5662 1.2896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1641 0.6100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9541 1.3939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6392 1.8249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4159 2.9831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4822 2.5419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5995 0.5712 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4536 0.3163 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 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
1 18 1 0 0 0 0
8 19 1 0 0 0 0
3 20 1 0 0 0 0
21 15 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
22 28 1 0 0 0 0
23 29 1 0 0 0 0
24 30 1 0 0 0 0
6 31 1 0 0 0 0
31 25 1 0 0 0 0
S SKP 5
ID FL5FFAGS0004
FORMULA C20H18O11
EXACTMASS 434.084911418
AVERAGEMASS 434.35032
SMILES c(c4)c(ccc(O)4)C(O1)=C(C(c(c2O)c1c(OC(O3)C(O)C(C(O)C3)O)c(O)c2)=O)O
M END
