Mol:FL1D19NS0002
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
19 20 0 0 0 0 0 0 0 0999 V2000
-1.8587 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8587 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1442 -1.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4297 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4297 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1442 0.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3303 -1.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0286 -0.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3303 -1.7757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0286 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7447 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4592 0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1736 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1736 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4592 1.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7447 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1707 0.5038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5042 0.5298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1736 0.1433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 0 0 0 0
4 7 1 0 0 0 0
7 8 1 0 0 0 0
7 9 2 0 0 0 0
8 10 1 0 0 0 0
10 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
5 17 1 0 0 0 0
1 18 1 0 0 0 0
18 19 1 0 0 0 0
S SKP 8
ID FL1D19NS0002
KNApSAcK_ID C00014591
NAME 2'-Hydroxy-4'-methoxydihydrochalcone;2'-Hydroxy-4'-methoxy-3-phenylpropiophenone
CAS_RN 22141-31-7
FORMULA C16H16O3
EXACTMASS 256.109944378
AVERAGEMASS 256.29643999999996
SMILES COc(c2)cc(O)c(c2)C(=O)CCc(c1)cccc1
M END
</pre>
