Mol:FL1DHYNS0005
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
22 23 0 0 0 0 0 0 0 0999 V2000
-2.5292 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5292 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8147 -1.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1002 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1002 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8147 0.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3402 -1.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3581 -0.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3402 -1.7757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3581 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0742 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7887 0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5031 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5031 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7887 1.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0742 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4241 0.5474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1619 0.5224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9651 -1.0539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8147 -1.7735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4241 1.1802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1619 1.7435 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
5 17 1 0 0 0 0
1 18 1 0 0 0 0
8 19 1 0 0 0 0
3 20 1 0 0 0 0
17 21 1 0 0 0 0
14 22 1 0 0 0 0
S SKP 8
ID FL1DHYNS0005
KNApSAcK_ID C00014610
NAME 4,2',4',beta-Tetrahydroxy-6'-methoxydihydrochalcone;4,2',4',beta-Tetrahydroxy-6'-methoxy-alpha,beta-dihydrochalcone
CAS_RN 220443-00-5
FORMULA C16H16O6
EXACTMASS 304.094688244
AVERAGEMASS 304.29463999999996
SMILES COc(c2)c(c(O)cc(O)2)C(=O)C(O)Cc(c1)ccc(O)c1
M END
