Mol:075a FLIE
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(Redirected from Mol:075a FLID)
Copyright: ARM project http://www.metabolome.jp/
27 30 0 0 0 0 0 0 0 0999 V2000
-2.9070 2.3114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9070 1.4866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1926 1.0742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4781 1.4866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4781 2.3114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1926 2.7239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7639 1.0742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0494 1.4866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0494 2.3114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7639 2.7239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6648 1.0743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6648 0.1921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4287 -0.2489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1926 0.1921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1926 1.0743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4287 1.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7550 0.1922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6650 2.7239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1926 0.2492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6215 2.7239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9070 -0.2204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6215 0.1921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4287 -1.0739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7142 -1.4864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7142 -2.3114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4287 -2.7239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0003 -2.7239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2 3 2 0
3 4 1 0
4 5 2 0
5 6 1 0
6 1 2 0
4 7 1 0
7 8 2 0
8 9 1 0
9 10 1 0
10 5 1 0
8 11 1 0
11 12 2 0
12 13 1 0
13 14 2 0
15 16 2 0
16 11 1 0
12 17 1 0
7 17 1 0
2 1 1 0
9 18 2 0
15 14 1 0
3 19 1 0
1 20 1 0
14 21 1 0
21 22 1 0
13 23 1 0
23 24 1 0
24 25 2 0
25 26 1 0
25 27 1 0
S SKP 5
ID 075a FLID
FORMULA C21H18O6
EXACTMASS 366.110338308
AVERAGEMASS 366.36402
SMILES CC(C)=CCc(c(OC)4)c(o1)c(cc4)c(C(=O)2)c1c(c(O)3)c(cc(O)c3)O2
M END
