Mol:FL3FACCS0038
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
31 34 0 0 0 0 0 0 0 0999 V2000
-1.8537 -0.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8537 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1391 -1.4055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4246 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4246 -0.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1391 0.2446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2899 -1.4055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0044 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0044 -0.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2899 0.2446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1391 -2.2302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7244 0.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4036 -0.1182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0827 0.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0827 1.0582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4036 1.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7244 1.0582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7618 1.4502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2899 -2.2345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0830 1.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6857 0.8584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8888 1.0168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1679 0.8978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5985 1.5129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3116 1.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7618 1.4924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4199 1.0507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5818 2.0777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7933 1.9943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5679 0.2444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4036 2.2345 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
3 11 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
9 12 1 0 0 0 0
15 18 1 0 0 0 0
7 19 2 0 0 0 0
20 21 1 1 0 0 0
21 22 1 1 0 0 0
23 22 1 1 0 0 0
23 24 1 0 0 0 0
24 25 1 0 0 0 0
25 20 1 0 0 0 0
20 26 1 0 0 0 0
21 27 1 0 0 0 0
24 28 1 0 0 0 0
25 29 1 0 0 0 0
6 23 1 0 0 0 0
1 30 1 0 0 0 0
16 31 1 0 0 0 0
S SKP 5
ID FL3FACCS0038
FORMULA C21H20O10
EXACTMASS 432.10564686
AVERAGEMASS 432.37749999999994
SMILES c(O)(c2)c(C(=O)4)c(OC(=C4)c(c3)cc(c(O)c3)O)c(c(O)2)C(C(O)1)OC(C)C(O)C1O
M END
