Mol:FL1DA9NM0008
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
20 21 0 0 0 0 0 0 0 0999 V2000
-2.1933 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1933 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4788 -1.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7644 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7644 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4788 0.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0044 -1.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6940 -0.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0044 -1.7757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6940 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4101 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1245 0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8390 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8390 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1245 1.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4101 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1522 0.5105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8390 0.5299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4788 -1.7606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4788 1.2957 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
3 19 1 0 0 0 0
6 20 1 0 0 0 0
S SKP 8
ID FL1DA9NM0008
KNApSAcK_ID C00014594
NAME 3'-Methyl-2',4',6'-trihydroxydihydrochalcone
CAS_RN 70155-33-8
FORMULA C16H16O4
EXACTMASS 272.104859
AVERAGEMASS 272.29584
SMILES Oc(c1)c(C)c(O)c(C(=O)CCc(c2)cccc2)c(O)1
M END
</pre>
