Mol:FL1DRTNS0007
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
19 20 0 0 0 0 0 0 0 0999 V2000
-2.5095 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5095 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7950 -1.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0806 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0806 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7950 0.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3206 -1.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3778 -0.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3206 -1.7757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3778 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0938 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8083 0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5228 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5228 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8083 1.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0938 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1552 0.5299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1552 1.7283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4623 1.7278 0.0000 O 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
1 17 1 0 0 0 0
14 18 1 0 0 0 0
16 19 1 0 0 0 0
S SKP 8
ID FL1DRTNS0007
KNApSAcK_ID C00014596
NAME 2,4,4'-Trihydroxydihydrochalcone
CAS_RN 15097-74-2
FORMULA C15H14O4
EXACTMASS 258.089208936
AVERAGEMASS 258.26926000000003
SMILES Oc(c2)ccc(c2)C(=O)CCc(c1)c(O)cc(O)c1
M END
</pre>
