Mol:FL1C19NS0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
18 19 0 0 0 0 0 0 0 0999 V2000
-1.9517 0.6382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9517 -0.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3953 -0.3254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8390 -0.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8390 0.6382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3953 0.9594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2827 -0.3254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2736 -0.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8297 -0.3252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3857 -0.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9467 -0.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5077 -0.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5077 0.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9467 0.9675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3857 0.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2827 -0.8267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3953 -0.9675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5077 0.9592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 1 2 0 0 0 0
4 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 11 2 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 10 1 0 0 0 0
7 16 2 0 0 0 0
3 17 1 0 0 0 0
1 18 1 0 0 0 0
S SKP 8
ID FL1C19NS0001
KNApSAcK_ID C00006920
NAME 2',4'-Dihydroxychalcone
CAS_RN 1776-30-3
FORMULA C15H12O3
EXACTMASS 240.07864425
AVERAGEMASS 240.25398
SMILES Oc(c2)cc(O)c(c2)C(=O)C=Cc(c1)cccc1
M END
