Mol:FL2FA8NS0006
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
21 23 0 0 0 0 0 0 0 0999 V2000
-1.8618 0.1441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8618 -0.6809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1473 -1.0934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4329 -0.6809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4329 0.1441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1473 0.5566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2816 -1.0934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9961 -0.6809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9961 0.1441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2816 0.5566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7546 0.5820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4691 0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1835 0.5820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1835 1.4070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4691 1.8195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7546 1.4070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2816 -1.8195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1473 -1.7866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4691 -0.5822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5361 0.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1835 0.1595 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
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
9 11 1 6 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
7 17 2 0 0 0 0
3 18 1 0 0 0 0
12 19 1 0 0 0 0
1 20 1 0 0 0 0
20 21 1 0 0 0 0
S SKP 8
ID FL2FA8NS0006
KNApSAcK_ID C00014114
NAME Dihydroechioidinin;5,2'-Dihydroxy-7-methoxyflavanone
CAS_RN 62346-19-4
FORMULA C16H14O5
EXACTMASS 286.084123558
AVERAGEMASS 286.27936
SMILES COc(c3)cc(O1)c(c(O)3)C(=O)CC1c(c2)c(O)ccc2
M END
</pre>
