Mol:FL1CA8NS0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
23 24 0 0 0 0 0 0 0 0999 V2000
-2.5006 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 1.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2151 1.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 1.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 -1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 -1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2151 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 1.8563 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 2 0 0 0 0
7 9 1 0 0 0 0
9 10 2 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
16 19 1 0 0 0 0
3 20 1 0 0 0 0
20 21 1 0 0 0 0
18 22 1 0 0 0 0
19 23 1 0 0 0 0
S SKP 8
ID FL1CA8NS0002
KNApSAcK_ID C00014423
NAME 2'-Hydroxy-2,4',6'-trimethoxychalcone
CAS_RN 118267-80-4
FORMULA C18H18O5
EXACTMASS 314.115423686
AVERAGEMASS 314.33252
SMILES c(c1C(=O)C=Cc(c2)c(OC)ccc2)(O)cc(OC)cc1OC
M END
