Mol:FL1B99NSH001
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
19 21 0 0 0 0 0 0 0 0999 V2000
-2.1445 -1.0780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1445 -1.9030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4300 -2.3155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4300 -0.6655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7156 -1.9030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7156 -1.0780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0014 -0.6640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7150 -1.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7141 -1.9032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2975 -2.4866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4295 -0.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4295 0.1579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1445 0.5707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1443 1.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4296 1.8079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7154 1.3953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7156 0.5703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4296 2.4866 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
1.3922 -1.4702 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 5 2 0 0 0 0
6 4 2 0 0 0 0
4 1 1 0 0 0 0
5 6 1 0 0 0 0
6 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
5 9 1 0 0 0 0
9 10 2 0 0 0 0
8 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 12 1 0 0 0 0
15 18 1 0 0 0 0
8 19 1 0 0 0 0
S SKP 8
ID FL1B99NSH001
KNApSAcK_ID C00014662
NAME 4'-Chloro-2-hydroxyaurone
CAS_RN 329763-01-1
FORMULA C15H11ClO3
EXACTMASS 274.03967192799996
AVERAGEMASS 274.69874000000004
SMILES Clc(c3)ccc(c3)CC(O)(O1)C(=O)c(c2)c(ccc2)1
M END
</pre>
