Mol:FL2FALNS0006
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
23 25 0 0 0 0 0 0 0 0999 V2000
-2.4866 0.1441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4866 -0.6809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7722 -1.0934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0577 -0.6809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0577 0.1441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7722 0.5566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3432 -1.0934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3713 -0.6809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3713 0.1441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3432 0.5566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1298 0.5820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8442 0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5587 0.5820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5587 1.4070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8442 1.8195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1298 1.4070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3432 -1.8195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7722 -1.7866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1570 0.5311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8442 -0.5490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7797 0.1716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1911 1.7721 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7797 1.4322 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 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
7 17 2 0 0 0 0
3 18 1 0 0 0 0
1 19 1 0 0 0 0
12 20 1 0 0 0 0
19 21 1 0 0 0 0
14 22 1 0 0 0 0
22 23 1 0 0 0 0
S SKP 8
ID FL2FALNS0006
KNApSAcK_ID C00014123
NAME 5,2'-Dihydroxy-7,4'-dimethoxyflavanone
CAS_RN 167319-11-1
FORMULA C17H16O6
EXACTMASS 316.094688244
AVERAGEMASS 316.30534
SMILES COc(c3)cc(O)c(c3)C(C1)Oc(c2)c(c(O)cc(OC)2)C(=O)1
M END
