Mol:FL1D1CNS0004
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
23 25 0 0 0 0 0 0 0 0999 V2000
-2.1631 -0.2895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1631 -1.1145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4486 -1.5270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7341 -1.1145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7341 -0.2895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4486 0.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0258 -1.5533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7242 -1.1501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0258 -2.2223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7242 -0.3218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4403 0.0916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1547 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8692 0.0916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8692 0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1547 1.3291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4403 0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1429 0.0519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8371 0.0996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4823 -0.2729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1429 0.7175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4823 1.4686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1468 2.2223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3263 2.1360 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
18 19 1 0 0 0 0
17 20 1 0 0 0 0
14 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 0 0 0 0
23 15 1 0 0 0 0
S SKP 8
ID FL1D1CNS0004
KNApSAcK_ID C00014602
NAME Ponganone VII;2',4'-Dimethoxy-3,4-methylenedioxydihydrochalcone
CAS_RN 142608-93-3
FORMULA C18H18O5
EXACTMASS 314.115423686
AVERAGEMASS 314.33252
SMILES c(O3)(c1)c(OC3)ccc(CCC(c(c2)c(OC)cc(OC)c2)=O)1
M END
