Mol:FL1DA9NM0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
21 22 0 0 0 0 0 0 0 0999 V2000
-1.6639 0.1343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6639 -0.4024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1991 -0.6707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7344 -0.4024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7344 0.1343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1991 0.4026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1991 -1.2070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2700 -0.6705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1933 -0.4031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6565 -0.6705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1197 -0.4031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5829 -0.6705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0461 -0.4031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0461 0.1318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5829 0.3992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1197 0.1318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2700 -1.2054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0461 0.3550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2700 0.4024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1991 0.9388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6635 1.2070 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
3 7 1 0 0 0 0
4 8 1 0 0 0 0
8 9 1 0 0 0 0
9 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
8 17 2 0 0 0 0
1 18 1 0 0 0 0
5 19 1 0 0 0 0
6 20 1 0 0 0 0
20 21 2 0 0 0 0
S SKP 8
ID FL1DA9NM0001
KNApSAcK_ID C00007994
NAME 3'-Formyl-2',4',6'-trihydroxydihydrochalcone
CAS_RN 135383-81-2
FORMULA C16H14O5
EXACTMASS 286.084123558
AVERAGEMASS 286.27936
SMILES O=Cc(c(O)1)c(O)c(C(=O)CCc(c2)cccc2)c(O)c1
M END
